ethyl 2-[(diphenylmethyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(diphenylmethyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(benzhydrylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzhydrylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(benzhydrylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H24N2O2S2 MolecularWeight: 472.62166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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