methyl 5-methyl-4-phenyl-2-[[phenyl-(phenylmethyl)carbamothioyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-[[phenyl-(phenylmethyl)carbamothioyl]amino]thiophene-3-carboxylate Openeye Name: methyl 2-[[benzyl(phenyl)carbamothioyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-4-phenyl-2-[[(N-(phenylmethyl)anilino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[benzyl(phenyl)carbamothioyl]amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[benzyl(phenyl)thiocarbamoyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C27H24N2O2S2 MolecularWeight: 472.62166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)N(CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)N(CC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O2S2/c1-19-23(21-14-8-4-9-15-21)24(26(30)31-2)25(33-19)28-27(32)29(22-16-10-5-11-17-22)18-20-12-6-3-7-13-20/h3-17H,18H2,1-2H3,(H,28,32)