methyl 3-[(4-methylpiperidin-1-yl)carbothioylcarbamoyl]benzoate

Systemtic Name: methyl 3-[(4-methylpiperidin-1-yl)carbothioylcarbamoyl]benzoate Openeye Name: methyl 3-[(4-methylpiperidine-1-carbothioyl)carbamoyl]benzoate CAS Name: 3-[[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-methylpiperidine-1-carbothioyl)carbamoyl]benzoate Traditional Name: 3-[(4-methylpiperidine-1-carbothioyl)carbamoyl]benzoic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)C(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C16H20N2O3S/c1-11-6-8-18(9-7-11)16(22)17-14(19)12-4-3-5-13(10-12)15(20)21-2/h3-5,10-11H,6-9H2,1-2H3,(H,17,19,22)