propyl 4-[[4-(diphenylmethyl)piperazin-1-yl]carbothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[4-(diphenylmethyl)piperazin-1-yl]carbothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[(4-benzhydrylpiperazine-1-carbothioyl)amino]-4-oxo-butanoate CAS Name: 4-[[[4-(diphenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[(4-benzhydrylpiperazine-1-carbothioyl)amino]-4-oxobutanoate Traditional Name: 4-[(4-benzhydrylpiperazine-1-carbothioyl)amino]-4-keto-butyric acid propyl ester Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O3S/c1-2-19-31-23(30)14-13-22(29)26-25(32)28-17-15-27(16-18-28)24(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,24H,2,13-19H2,1H3,(H,26,29,32)