N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide

C215H271F3N24O35S11 — CID 157322858

IUPACN-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide
SMILESCC1COc2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2O1.CC1c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2C(C)C1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc(C(F)(F)F)c1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CC(C)C2.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CCC2C.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)cc(C)c1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)c(C)cc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2c1CCC2.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2scnc12
InChIInChI=1S/C25H35N3O4S.2C24H33N3O4S.C22H28N2O3S.3C21H26N2O3S.C19H21F3N2O3S.C19H21N3O3S2.C19H22N2O5S/c1-15(2)33(30,31)27-22-10-8-21(9-11-22)25(29)26-23-12-17(4)24(13-16(23)3)28-14-18(5)32-20(7)19(28)6;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-16(3)11-22(12-17(23)4)27-13-18(5)31-19(6)14-27;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-12-11-22(13-16(23)3)27-14-17(4)31-19(6)18(27)5;1-13(2)28(26,27)24-18-8-6-17(7-9-18)22(25)23-19-10-11-20-15(4)14(3)16(5)21(20)12-19;1-13(2)27(25,26)23-17-8-6-16(7-9-17)21(24)22-20-12-11-18-14(3)5-10-19(18)15(20)4;1-13(2)27(25,26)23-18-8-5-16(6-9-18)21(24)22-20-10-7-17-11-14(3)12-19(17)15(20)4;1-13(2)27(25,26)23-17-10-8-16(9-11-17)21(24)22-20-12-14(3)18-6-5-7-19(18)15(20)4;1-11(2)28(26,27)24-15-7-5-14(6-8-15)18(25)23-17-10-9-16(19(20,21)22)12(3)13(17)4;1-11(2)27(24,25)22-15-7-5-14(6-8-15)19(23)21-16-9-12(3)17-18(13(16)4)26-10-20-17;1-12(2)27(23,24)21-15-6-4-14(5-7-15)19(22)20-16-8-9-17-18(10-16)26-13(3)11-25-17/h8-13,15,18-20,27H,14H2,1-7H3,(H,26,29);7-12,15,18-19,26H,13-14H2,1-6H3,(H,25,28);7-13,15,17-19,26H,14H2,1-6H3,(H,25,28);6-16,24H,1-5H3,(H,23,25);6-9,11-14,23H,5,10H2,1-4H3,(H,22,24);5-10,13-14,23H,11-12H2,1-4H3,(H,22,24);8-13,23H,5-7H2,1-4H3,(H,22,24);5-11,24H,1-4H3,(H,23,25);5-11,22H,1-4H3,(H,21,23);4-10,12-13,21H,11H2,1-3H3,(H,20,22)/t18-,19?,20+;18-,19+;17-,18?,19+;;;;;;;/m0.0......./s1
InChIKeyBEJIDTISVLBSCG-VOGVGGBZSA-N
MW4161.40 g/mol
LogP43.44
Rot. Bonds53

About N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide

N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide (PubChem CID 157322858) has the molecular formula C215H271F3N24O35S11 and a molecular weight of 4161.40 g/mol. Its IUPAC name is N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide.

Molecular Properties

Compound NameN-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide
PubChem CID157322858
Molecular FormulaC215H271F3N24O35S11
Molecular Weight4161.40 g/mol
Exact Mass4157.70
IUPAC NameN-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide
SMILESCC1COc2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2O1.CC1c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2C(C)C1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc(C(F)(F)F)c1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CC(C)C2.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CCC2C.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)cc(C)c1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)c(C)cc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2c1CCC2.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2scnc12
InChIInChI=1S/C25H35N3O4S.2C24H33N3O4S.C22H28N2O3S.3C21H26N2O3S.C19H21F3N2O3S.C19H21N3O3S2.C19H22N2O5S/c1-15(2)33(30,31)27-22-10-8-21(9-11-22)25(29)26-23-12-17(4)24(13-16(23)3)28-14-18(5)32-20(7)19(28)6;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-16(3)11-22(12-17(23)4)27-13-18(5)31-19(6)14-27;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-12-11-22(13-16(23)3)27-14-17(4)31-19(6)18(27)5;1-13(2)28(26,27)24-18-8-6-17(7-9-18)22(25)23-19-10-11-20-15(4)14(3)16(5)21(20)12-19;1-13(2)27(25,26)23-17-8-6-16(7-9-17)21(24)22-20-12-11-18-14(3)5-10-19(18)15(20)4;1-13(2)27(25,26)23-18-8-5-16(6-9-18)21(24)22-20-10-7-17-11-14(3)12-19(17)15(20)4;1-13(2)27(25,26)23-17-10-8-16(9-11-17)21(24)22-20-12-14(3)18-6-5-7-19(18)15(20)4;1-11(2)28(26,27)24-15-7-5-14(6-8-15)18(25)23-17-10-9-16(19(20,21)22)12(3)13(17)4;1-11(2)27(24,25)22-15-7-5-14(6-8-15)19(23)21-16-9-12(3)17-18(13(16)4)26-10-20-17;1-12(2)27(23,24)21-15-6-4-14(5-7-15)19(22)20-16-8-9-17-18(10-16)26-13(3)11-25-17/h8-13,15,18-20,27H,14H2,1-7H3,(H,26,29);7-12,15,18-19,26H,13-14H2,1-6H3,(H,25,28);7-13,15,17-19,26H,14H2,1-6H3,(H,25,28);6-16,24H,1-5H3,(H,23,25);6-9,11-14,23H,5,10H2,1-4H3,(H,22,24);5-10,13-14,23H,11-12H2,1-4H3,(H,22,24);8-13,23H,5-7H2,1-4H3,(H,22,24);5-11,24H,1-4H3,(H,23,25);5-11,22H,1-4H3,(H,21,23);4-10,12-13,21H,11H2,1-3H3,(H,20,22)/t18-,19?,20+;18-,19+;17-,18?,19+;;;;;;;/m0.0......./s1
InChIKeyBEJIDTISVLBSCG-VOGVGGBZSA-N
XLogP43.44
TPSA821.46 Ų
H-Bond Donors20
H-Bond Acceptors40
Rotatable Bonds53
Heavy Atoms288
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004161.40
LogP ≤ 543.44
H-Bond Donors ≤ 520
H-Bond Acceptors ≤ 1040

Analyze N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide?
The IUPAC name of N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide (CID 157322858) is N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide.
What is the SMILES notation for N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide?
The canonical SMILES for N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide is CC1COc2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2O1.CC1c2ccc(NC(=O)c3ccc(NS(=O)(=O)C(C)C)cc3)cc2C(C)C1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc(C(F)(F)F)c1C.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CC(C)C2.Cc1c(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)ccc2c1CCC2C.Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)cc(C)c1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)c(C)cc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(N2C[C@H](C)O[C@H](C)C2C)ccc1NC(=O)c1ccc(NS(=O)(=O)C(C)C)cc1.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2c1CCC2.Cc1cc(NC(=O)c2ccc(NS(=O)(=O)C(C)C)cc2)c(C)c2scnc12.
What is the InChIKey of N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide?
The InChIKey is BEJIDTISVLBSCG-VOGVGGBZSA-N. The full InChI is InChI=1S/C25H35N3O4S.2C24H33N3O4S.C22H28N2O3S.3C21H26N2O3S.C19H21F3N2O3S.C19H21N3O3S2.C19H22N2O5S/c1-15(2)33(30,31)27-22-10-8-21(9-11-22)25(29)26-23-12-17(4)24(13-16(23)3)28-14-18(5)32-20(7)19(28)6;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-16(3)11-22(12-17(23)4)27-13-18(5)31-19(6)14-27;1-15(2)32(29,30)26-21-9-7-20(8-10-21)24(28)25-23-12-11-22(13-16(23)3)27-14-17(4)31-19(6)18(27)5;1-13(2)28(26,27)24-18-8-6-17(7-9-18)22(25)23-19-10-11-20-15(4)14(3)16(5)21(20)12-19;1-13(2)27(25,26)23-17-8-6-16(7-9-17)21(24)22-20-12-11-18-14(3)5-10-19(18)15(20)4;1-13(2)27(25,26)23-18-8-5-16(6-9-18)21(24)22-20-10-7-17-11-14(3)12-19(17)15(20)4;1-13(2)27(25,26)23-17-10-8-16(9-11-17)21(24)22-20-12-14(3)18-6-5-7-19(18)15(20)4;1-11(2)28(26,27)24-15-7-5-14(6-8-15)18(25)23-17-10-9-16(19(20,21)22)12(3)13(17)4;1-11(2)27(24,25)22-15-7-5-14(6-8-15)19(23)21-16-9-12(3)17-18(13(16)4)26-10-20-17;1-12(2)27(23,24)21-15-6-4-14(5-7-15)19(22)20-16-8-9-17-18(10-16)26-13(3)11-25-17/h8-13,15,18-20,27H,14H2,1-7H3,(H,26,29);7-12,15,18-19,26H,13-14H2,1-6H3,(H,25,28);7-13,15,17-19,26H,14H2,1-6H3,(H,25,28);6-16,24H,1-5H3,(H,23,25);6-9,11-14,23H,5,10H2,1-4H3,(H,22,24);5-10,13-14,23H,11-12H2,1-4H3,(H,22,24);8-13,23H,5-7H2,1-4H3,(H,22,24);5-11,24H,1-4H3,(H,23,25);5-11,22H,1-4H3,(H,21,23);4-10,12-13,21H,11H2,1-3H3,(H,20,22)/t18-,19?,20+;18-,19+;17-,18?,19+;;;;;;;/m0.0......./s1.
What are the key properties of N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide?
N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide has a molecular weight of 4161.40 g/mol, XLogP of 43.44, 53 rotatable bonds, 20 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,7-dimethyl-1,3-benzothiazol-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(1,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(2,4-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-(4,7-dimethyl-2,3-dihydro-1H-inden-5-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2,6-dimethylphenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,3-dimethyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-[2,5-dimethyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;N-(3-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-4-(propan-2-ylsulfonylamino)benzamide;N-[2-methyl-4-[(2R,6S)-2,3,6-trimethylmorpholin-4-yl]phenyl]-4-(propan-2-ylsulfonylamino)benzamide;4-(propan-2-ylsulfonylamino)-N-(1,2,3-trimethyl-2,3-dihydro-1H-inden-5-yl)benzamide is sourced from PubChem (CID 157322858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).