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

Systemtic Name: methyl 2-[(diphenylmethyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(benzhydrylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(benzhydrylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(benzhydrylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C26H22N2O2S2 MolecularWeight: 458.59508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22N2O2S2/c1-30-25(29)21-17-22(18-11-5-2-6-12-18)32-24(21)28-26(31)27-23(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17,23H,1H3,(H2,27,28,31)