1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea

C162H153ClFN27O24S6 — CID 158852372

IUPAC1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea
SMILESCOC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2cccc3ccccc23)cc1.COC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2Cl)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1ccc(F)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1cccc(-n2cccc2)c1
InChIInChI=1S/C30H27N5O5S.C29H27N5O3S.C27H27N5O5S.C26H26N4O4S.C25H23ClN4O4S.C25H23FN4O3S/c1-40-30(37)32-23-14-16-24(17-15-23)35-19-18-31-28(35)26(20-21-8-3-2-4-9-21)33-29(36)34-41(38,39)27-13-7-11-22-10-5-6-12-25(22)27;1-22-10-5-6-15-27(22)38(36,37)32-29(35)31-26(20-23-11-3-2-4-12-23)28-30-16-19-34(28)25-14-9-13-24(21-25)33-17-7-8-18-33;1-19-8-6-7-11-24(19)38(35,36)31-26(33)30-23(18-20-9-4-3-5-10-20)25-28-16-17-32(25)22-14-12-21(13-15-22)29-27(34)37-2;1-19-8-6-7-11-24(19)35(32,33)29-26(31)28-23(18-20-9-4-3-5-10-20)25-27-16-17-30(25)21-12-14-22(34-2)15-13-21;1-34-20-13-11-19(12-14-20)30-16-15-27-24(30)22(17-18-7-3-2-4-8-18)28-25(31)29-35(32,33)23-10-6-5-9-21(23)26;1-18-7-5-6-10-23(18)34(32,33)29-25(31)28-22(17-19-8-3-2-4-9-19)24-27-15-16-30(24)21-13-11-20(26)12-14-21/h2-19,26H,20H2,1H3,(H,32,37)(H2,33,34,36);2-19,21,26H,20H2,1H3,(H2,31,32,35);3-17,23H,18H2,1-2H3,(H,29,34)(H2,30,31,33);3-17,23H,18H2,1-2H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31)/t2*26-;2*23-;2*22-/m000000/s1
InChIKeyIZPSZQRZMDPAOZ-GNBHRNINSA-N
MW3109.02 g/mol
LogP27.41
Rot. Bonds47

About 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea

1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea (PubChem CID 158852372) has the molecular formula C162H153ClFN27O24S6 and a molecular weight of 3109.02 g/mol. Its IUPAC name is 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea.

Molecular Properties

Compound Name1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea
PubChem CID158852372
Molecular FormulaC162H153ClFN27O24S6
Molecular Weight3109.02 g/mol
Exact Mass3105.96
IUPAC Name1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea
SMILESCOC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2cccc3ccccc23)cc1.COC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2Cl)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1ccc(F)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1cccc(-n2cccc2)c1
InChIInChI=1S/C30H27N5O5S.C29H27N5O3S.C27H27N5O5S.C26H26N4O4S.C25H23ClN4O4S.C25H23FN4O3S/c1-40-30(37)32-23-14-16-24(17-15-23)35-19-18-31-28(35)26(20-21-8-3-2-4-9-21)33-29(36)34-41(38,39)27-13-7-11-22-10-5-6-12-25(22)27;1-22-10-5-6-15-27(22)38(36,37)32-29(35)31-26(20-23-11-3-2-4-12-23)28-30-16-19-34(28)25-14-9-13-24(21-25)33-17-7-8-18-33;1-19-8-6-7-11-24(19)38(35,36)31-26(33)30-23(18-20-9-4-3-5-10-20)25-28-16-17-32(25)22-14-12-21(13-15-22)29-27(34)37-2;1-19-8-6-7-11-24(19)35(32,33)29-26(31)28-23(18-20-9-4-3-5-10-20)25-27-16-17-30(25)21-12-14-22(34-2)15-13-21;1-34-20-13-11-19(12-14-20)30-16-15-27-24(30)22(17-18-7-3-2-4-8-18)28-25(31)29-35(32,33)23-10-6-5-9-21(23)26;1-18-7-5-6-10-23(18)34(32,33)29-25(31)28-22(17-19-8-3-2-4-9-19)24-27-15-16-30(24)21-13-11-20(26)12-14-21/h2-19,26H,20H2,1H3,(H,32,37)(H2,33,34,36);2-19,21,26H,20H2,1H3,(H2,31,32,35);3-17,23H,18H2,1-2H3,(H,29,34)(H2,30,31,33);3-17,23H,18H2,1-2H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31)/t2*26-;2*23-;2*22-/m000000/s1
InChIKeyIZPSZQRZMDPAOZ-GNBHRNINSA-N
XLogP27.41
TPSA658.59 Ų
H-Bond Donors14
H-Bond Acceptors37
Rotatable Bonds47
Heavy Atoms221
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003109.02
LogP ≤ 527.41
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1037

Analyze 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea with MolForge

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Related Compounds

1-[(1S)-1-[1-(4-aminophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-(2-fluorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;methyl N-[4-[2-[(1S)-1-[(2-chlorophenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(2-methoxyphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-2-phenyl-1-[[2-(trifluoromethoxy)phenyl]sulfonylcarbamoylamino]ethyl]imidazol-1-yl]phenyl]carbamate
CID 160104887
1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-2-phenylethyl]urea;1-(2-fluorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;methyl N-[4-[2-[(1S)-1-[(2-methoxyphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-[(1S)-1-[1-(4-methylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-2-phenyl-1-[[2-(trifluoromethoxy)phenyl]sulfonylcarbamoylamino]ethyl]imidazol-1-yl]phenyl]carbamate
CID 160210284
1-(2-fluorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;methyl N-[4-[2-[(1S)-1-[(2-chlorophenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(2-methoxyphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-[(1S)-1-[1-(4-methylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-2-phenyl-1-[[2-(trifluoromethoxy)phenyl]sulfonylcarbamoylamino]ethyl]imidazol-1-yl]phenyl]carbamate
CID 162170099
bis(1-[(1S)-1-[1-(4-cyclopenta-1,4-dien-1-ylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea);1-(2,3-dichlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-ethoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-(2,3-dichlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-(2-fluorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea
CID 157141786
1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(3,4-dimethoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-ethoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(3-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate
CID 158707803
1-[(1S)-1-[1-(3-chloro-4-propoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(2,3-dihydro-1-benzofuran-5-yl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(3,4-dimethylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-ethoxy-3-methylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;ethyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-[(1S)-1-[1-(3-methylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea
CID 158904651
1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-(benzenesulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1R)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(4-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-[(1S)-1-[1-(4-methylphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea
CID 161006999
1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea
CID 161614984
1-[(1S)-1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-(benzenesulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(2-chlorophenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-[(4-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate
CID 161947198

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea?
The IUPAC name of 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea (CID 158852372) is 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea.
What is the SMILES notation for 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea?
The canonical SMILES for 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea is COC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2cccc3ccccc23)cc1.COC(=O)Nc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2C)cc1.COc1ccc(-n2ccnc2[C@H](Cc2ccccc2)NC(=O)NS(=O)(=O)c2ccccc2Cl)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1ccc(F)cc1.Cc1ccccc1S(=O)(=O)NC(=O)N[C@@H](Cc1ccccc1)c1nccn1-c1cccc(-n2cccc2)c1.
What is the InChIKey of 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea?
The InChIKey is IZPSZQRZMDPAOZ-GNBHRNINSA-N. The full InChI is InChI=1S/C30H27N5O5S.C29H27N5O3S.C27H27N5O5S.C26H26N4O4S.C25H23ClN4O4S.C25H23FN4O3S/c1-40-30(37)32-23-14-16-24(17-15-23)35-19-18-31-28(35)26(20-21-8-3-2-4-9-21)33-29(36)34-41(38,39)27-13-7-11-22-10-5-6-12-25(22)27;1-22-10-5-6-15-27(22)38(36,37)32-29(35)31-26(20-23-11-3-2-4-12-23)28-30-16-19-34(28)25-14-9-13-24(21-25)33-17-7-8-18-33;1-19-8-6-7-11-24(19)38(35,36)31-26(33)30-23(18-20-9-4-3-5-10-20)25-28-16-17-32(25)22-14-12-21(13-15-22)29-27(34)37-2;1-19-8-6-7-11-24(19)35(32,33)29-26(31)28-23(18-20-9-4-3-5-10-20)25-27-16-17-30(25)21-12-14-22(34-2)15-13-21;1-34-20-13-11-19(12-14-20)30-16-15-27-24(30)22(17-18-7-3-2-4-8-18)28-25(31)29-35(32,33)23-10-6-5-9-21(23)26;1-18-7-5-6-10-23(18)34(32,33)29-25(31)28-22(17-19-8-3-2-4-9-19)24-27-15-16-30(24)21-13-11-20(26)12-14-21/h2-19,26H,20H2,1H3,(H,32,37)(H2,33,34,36);2-19,21,26H,20H2,1H3,(H2,31,32,35);3-17,23H,18H2,1-2H3,(H,29,34)(H2,30,31,33);3-17,23H,18H2,1-2H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31);2-16,22H,17H2,1H3,(H2,28,29,31)/t2*26-;2*23-;2*22-/m000000/s1.
What are the key properties of 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea?
1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea has a molecular weight of 3109.02 g/mol, XLogP of 27.41, 47 rotatable bonds, 14 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)sulfonyl-3-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]urea;1-[(1S)-1-[1-(4-fluorophenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;1-[(1S)-1-[1-(4-methoxyphenyl)imidazol-2-yl]-2-phenylethyl]-3-(2-methylphenyl)sulfonylurea;methyl N-[4-[2-[(1S)-1-[(2-methylphenyl)sulfonylcarbamoylamino]-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;methyl N-[4-[2-[(1S)-1-(naphthalen-1-ylsulfonylcarbamoylamino)-2-phenylethyl]imidazol-1-yl]phenyl]carbamate;1-(2-methylphenyl)sulfonyl-3-[(1S)-2-phenyl-1-[1-(3-pyrrol-1-ylphenyl)imidazol-2-yl]ethyl]urea is sourced from PubChem (CID 158852372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).