methyl 4-[(diphenylmethyl)carbamothioylamino]benzoate

Systemtic Name: methyl 4-[(diphenylmethyl)carbamothioylamino]benzoate Openeye Name: methyl 4-(benzhydrylcarbamothioylamino)benzoate CAS Name: 4-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(benzhydrylcarbamothioylamino)benzoate Traditional Name: 4-(benzhydrylthiocarbamoylamino)benzoic acid methyl ester Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O2S/c1-26-21(25)18-12-14-19(15-13-18)23-22(27)24-20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15,20H,1H3,(H2,23,24,27)