methyl 4,5-dimethoxy-2-[[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]carbothioylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]carbothioylamino]benzoate Openeye Name: methyl 2-[[4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]-sulfanylidenemethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C29H32N2O5S MolecularWeight: 520.63978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)OC

InChI

InChI=1S/C29H32N2O5S/c1-34-25-18-23(27(32)36-3)24(19-26(25)35-2)30-28(37)31-16-14-22(15-17-31)29(33,20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,18-19,22,33H,14-17H2,1-3H3,(H,30,37)