ethyl 2-butyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-5-thiophen-2-ylsulfanyl-imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-5-thiophen-2-ylsulfanyl-imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-5-(2-thienylsulfanyl)imidazole-4-carboxylate CAS Name: 2-butyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-5-(thiophen-2-ylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-5-thiophen-2-ylsulfanylimidazole-4-carboxylate Traditional Name: 2-butyl-3-[4-(2-sulfamoylphenyl)benzyl]-5-(2-thienylthio)imidazole-4-carboxylic acid ethyl ester Formula: C27H29N3O4S3 MolecularWeight: 555.73186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)OCC)SC4=CC=CS4

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)OCC)SC4=CC=CS4

InChI

InChI=1S/C27H29N3O4S3/c1-3-5-11-23-29-26(36-24-12-8-17-35-24)25(27(31)34-4-2)30(23)18-19-13-15-20(16-14-19)21-9-6-7-10-22(21)37(28,32)33/h6-10,12-17H,3-5,11,18H2,1-2H3,(H2,28,32,33)