ethyl 1-[(2,4-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(2,4-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(2,4-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate CAS Name: 1-[(2,4-dimethoxyanilino)-sulfanylidenemethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2,4-dimethoxyphenyl)carbamothioyl]piperidine-3-carboxylate Traditional Name: 1-[(2,4-dimethoxyphenyl)thiocarbamoyl]nipecotic acid ethyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=S)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=S)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C17H24N2O4S/c1-4-23-16(20)12-6-5-9-19(11-12)17(24)18-14-8-7-13(21-2)10-15(14)22-3/h7-8,10,12H,4-6,9,11H2,1-3H3,(H,18,24)