4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide

C188H146Cl18F6N54O36S4 — CID 162148633

IUPAC4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide
SMILESCONC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)ncn1.CONC(=O)c1cc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ncn1.CONC(=O)c1nccc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1nccc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1.CONC(=O)c1ncnc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1ncnc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1
InChIInChI=1S/C20H15ClF3N5O3S.4C19H15Cl2N5O4.C19H15Cl2N5O3S.C19H14ClF3N6O3S.2C18H14Cl2N6O4.C18H14Cl2N6O3S/c1-32-29-18(30)16-9-13(6-7-25-16)33-17-5-3-12(10-26-17)28-19(31)27-11-2-4-15(21)14(8-11)20(22,23)24;1-29-26-18(27)16-9-17(23-10-22-16)30-13-5-2-11(3-6-13)24-19(28)25-12-4-7-14(20)15(21)8-12;1-29-26-18(27)17-22-9-8-16(25-17)30-13-5-2-11(3-6-13)23-19(28)24-12-4-7-14(20)15(21)10-12;1-29-26-18(27)16-9-17(23-10-22-16)30-13-4-2-3-11(7-13)24-19(28)25-12-5-6-14(20)15(21)8-12;1-29-26-18(27)17-22-8-7-16(25-17)30-13-4-2-3-11(9-13)23-19(28)24-12-5-6-14(20)15(21)10-12;1-29-26-18(27)16-9-13(6-7-22-16)30-17-5-3-12(10-23-17)25-19(28)24-11-2-4-14(20)15(21)8-11;1-32-29-17(30)14-7-16(26-9-25-14)33-15-5-3-11(8-24-15)28-18(31)27-10-2-4-13(20)12(6-10)19(21,22)23;1-29-26-16(27)15-21-9-22-18(25-15)30-12-5-2-10(3-6-12)23-17(28)24-11-4-7-13(19)14(20)8-11;1-29-26-16(27)15-21-9-22-18(25-15)30-12-4-2-3-10(7-12)23-17(28)24-11-5-6-13(19)14(20)8-11;1-29-26-17(27)14-7-16(23-9-22-14)30-15-5-3-11(8-21-15)25-18(28)24-10-2-4-12(19)13(20)6-10/h2-10H,1H3,(H,29,30)(H2,27,28,31);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-9H,1H3,(H,29,30)(H2,27,28,31);2*2-9H,1H3,(H,26,27)(H2,23,24,28);2-9H,1H3,(H,26,27)(H2,24,25,28)
InChIKeyZKWZELNVPXTVMI-UHFFFAOYSA-N
MW4617.99 g/mol
LogP44.86
Rot. Bonds60

About 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide

4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide (PubChem CID 162148633) has the molecular formula C188H146Cl18F6N54O36S4 and a molecular weight of 4617.99 g/mol. Its IUPAC name is 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide.

Molecular Properties

Compound Name4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide
PubChem CID162148633
Molecular FormulaC188H146Cl18F6N54O36S4
Molecular Weight4617.99 g/mol
Exact Mass4606.44
IUPAC Name4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide
SMILESCONC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)ncn1.CONC(=O)c1cc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ncn1.CONC(=O)c1nccc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1nccc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1.CONC(=O)c1ncnc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1ncnc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1
InChIInChI=1S/C20H15ClF3N5O3S.4C19H15Cl2N5O4.C19H15Cl2N5O3S.C19H14ClF3N6O3S.2C18H14Cl2N6O4.C18H14Cl2N6O3S/c1-32-29-18(30)16-9-13(6-7-25-16)33-17-5-3-12(10-26-17)28-19(31)27-11-2-4-15(21)14(8-11)20(22,23)24;1-29-26-18(27)16-9-17(23-10-22-16)30-13-5-2-11(3-6-13)24-19(28)25-12-4-7-14(20)15(21)8-12;1-29-26-18(27)17-22-9-8-16(25-17)30-13-5-2-11(3-6-13)23-19(28)24-12-4-7-14(20)15(21)10-12;1-29-26-18(27)16-9-17(23-10-22-16)30-13-4-2-3-11(7-13)24-19(28)25-12-5-6-14(20)15(21)8-12;1-29-26-18(27)17-22-8-7-16(25-17)30-13-4-2-3-11(9-13)23-19(28)24-12-5-6-14(20)15(21)10-12;1-29-26-18(27)16-9-13(6-7-22-16)30-17-5-3-12(10-23-17)25-19(28)24-11-2-4-14(20)15(21)8-11;1-32-29-17(30)14-7-16(26-9-25-14)33-15-5-3-11(8-24-15)28-18(31)27-10-2-4-13(20)12(6-10)19(21,22)23;1-29-26-16(27)15-21-9-22-18(25-15)30-12-5-2-10(3-6-12)23-17(28)24-11-4-7-13(19)14(20)8-11;1-29-26-16(27)15-21-9-22-18(25-15)30-12-4-2-3-10(7-12)23-17(28)24-11-5-6-13(19)14(20)8-11;1-29-26-17(27)14-7-16(23-9-22-14)30-15-5-3-11(8-21-15)25-18(28)24-10-2-4-12(19)13(20)6-10/h2-10H,1H3,(H,29,30)(H2,27,28,31);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-9H,1H3,(H,29,30)(H2,27,28,31);2*2-9H,1H3,(H,26,27)(H2,23,24,28);2-9H,1H3,(H,26,27)(H2,24,25,28)
InChIKeyZKWZELNVPXTVMI-UHFFFAOYSA-N
XLogP44.86
TPSA1159.34 Ų
H-Bond Donors30
H-Bond Acceptors64
Rotatable Bonds60
Heavy Atoms306
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004617.99
LogP ≤ 544.86
H-Bond Donors ≤ 530
H-Bond Acceptors ≤ 1064

Analyze 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide?
The IUPAC name of 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide (CID 162148633) is 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide.
What is the SMILES notation for 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide?
The canonical SMILES for 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide is CONC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)ncn1.CONC(=O)c1cc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cn2)ncn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ccn1.CONC(=O)c1cc(Sc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cn2)ncn1.CONC(=O)c1nccc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1nccc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1.CONC(=O)c1ncnc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1.CONC(=O)c1ncnc(Oc2cccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)c2)n1.
What is the InChIKey of 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide?
The InChIKey is ZKWZELNVPXTVMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClF3N5O3S.4C19H15Cl2N5O4.C19H15Cl2N5O3S.C19H14ClF3N6O3S.2C18H14Cl2N6O4.C18H14Cl2N6O3S/c1-32-29-18(30)16-9-13(6-7-25-16)33-17-5-3-12(10-26-17)28-19(31)27-11-2-4-15(21)14(8-11)20(22,23)24;1-29-26-18(27)16-9-17(23-10-22-16)30-13-5-2-11(3-6-13)24-19(28)25-12-4-7-14(20)15(21)8-12;1-29-26-18(27)17-22-9-8-16(25-17)30-13-5-2-11(3-6-13)23-19(28)24-12-4-7-14(20)15(21)10-12;1-29-26-18(27)16-9-17(23-10-22-16)30-13-4-2-3-11(7-13)24-19(28)25-12-5-6-14(20)15(21)8-12;1-29-26-18(27)17-22-8-7-16(25-17)30-13-4-2-3-11(9-13)23-19(28)24-12-5-6-14(20)15(21)10-12;1-29-26-18(27)16-9-13(6-7-22-16)30-17-5-3-12(10-23-17)25-19(28)24-11-2-4-14(20)15(21)8-11;1-32-29-17(30)14-7-16(26-9-25-14)33-15-5-3-11(8-24-15)28-18(31)27-10-2-4-13(20)12(6-10)19(21,22)23;1-29-26-16(27)15-21-9-22-18(25-15)30-12-5-2-10(3-6-12)23-17(28)24-11-4-7-13(19)14(20)8-11;1-29-26-16(27)15-21-9-22-18(25-15)30-12-4-2-3-10(7-12)23-17(28)24-11-5-6-13(19)14(20)8-11;1-29-26-17(27)14-7-16(23-9-22-14)30-15-5-3-11(8-21-15)25-18(28)24-10-2-4-12(19)13(20)6-10/h2-10H,1H3,(H,29,30)(H2,27,28,31);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-10H,1H3,(H,26,27)(H2,23,24,28);2-10H,1H3,(H,26,27)(H2,24,25,28);2-9H,1H3,(H,29,30)(H2,27,28,31);2*2-9H,1H3,(H,26,27)(H2,23,24,28);2-9H,1H3,(H,26,27)(H2,24,25,28).
What are the key properties of 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide?
4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide has a molecular weight of 4617.99 g/mol, XLogP of 44.86, 60 rotatable bonds, 30 hydrogen bond donors, and 64 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-2-carboxamide;6-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;6-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxypyrimidine-4-carboxamide;4-[3-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[4-[(3,4-dichlorophenyl)carbamoylamino]phenoxy]-N-methoxy-1,3,5-triazine-2-carboxamide;4-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyridine-2-carboxamide;6-[[5-[(3,4-dichlorophenyl)carbamoylamino]-2-pyridinyl]sulfanyl]-N-methoxypyrimidine-4-carboxamide is sourced from PubChem (CID 162148633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).