propan-2-yl 2-[(diphenylmethyl)carbamothioylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(diphenylmethyl)carbamothioylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-(benzhydrylcarbamothioylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(benzhydrylcarbamothioylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(benzhydrylthiocarbamoylamino)-4-(methylthio)butyric acid isopropyl ester Formula: C22H28N2O2S2 MolecularWeight: 416.59992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=S)NC(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=S)NC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C22H28N2O2S2/c1-16(2)26-21(25)19(14-15-28-3)23-22(27)24-20(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19-20H,14-15H2,1-3H3,(H2,23,24,27)