methyl 4-[[4-(2-methoxyphenyl)piperidin-1-yl]carbothioylamino]benzoate

Systemtic Name: methyl 4-[[4-(2-methoxyphenyl)piperidin-1-yl]carbothioylamino]benzoate Openeye Name: methyl 4-[[4-(2-methoxyphenyl)piperidine-1-carbothioyl]amino]benzoate CAS Name: 4-[[[4-(2-methoxyphenyl)-1-piperidinyl]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-methoxyphenyl)piperidine-1-carbothioyl]amino]benzoate Traditional Name: 4-[[4-(2-methoxyphenyl)piperidine-1-carbothioyl]amino]benzoic acid methyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O3S/c1-25-19-6-4-3-5-18(19)15-11-13-23(14-12-15)21(27)22-17-9-7-16(8-10-17)20(24)26-2/h3-10,15H,11-14H2,1-2H3,(H,22,27)