methyl 1-[(3-methoxyphenyl)carbamothioyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(3-methoxyphenyl)carbamothioyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(3-methoxyphenyl)carbamothioyl]piperidine-4-carboxylate CAS Name: 1-[(3-methoxyanilino)-sulfanylidenemethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-methoxyphenyl)carbamothioyl]piperidine-4-carboxylate Traditional Name: 1-[(3-methoxyphenyl)thiocarbamoyl]isonipecotic acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3S/c1-19-13-5-3-4-12(10-13)16-15(21)17-8-6-11(7-9-17)14(18)20-2/h3-5,10-11H,6-9H2,1-2H3,(H,16,21)