ethyl 5-methyl-2-[[4-[(2-methylphenyl)sulfamoyl]phenyl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-[[4-[(2-methylphenyl)sulfamoyl]phenyl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-2-[[4-(o-tolylsulfamoyl)phenyl]carbamothioylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[4-[(2-methylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[[4-[(2-methylphenyl)sulfamoyl]phenyl]carbamothioylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[[4-(o-tolylsulfamoyl)phenyl]thiocarbamoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H27N3O4S3 MolecularWeight: 565.72668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=CC=C4C

InChI

InChI=1S/C28H27N3O4S3/c1-4-35-27(32)25-24(20-11-6-5-7-12-20)19(3)37-26(25)30-28(36)29-21-14-16-22(17-15-21)38(33,34)31-23-13-9-8-10-18(23)2/h5-17,31H,4H2,1-3H3,(H2,29,30,36)