ethyl 1-[(4-methoxyphenyl)methylcarbamothioyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(4-methoxyphenyl)methylcarbamothioyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-methoxyphenyl)methylcarbamothioyl]piperidine-4-carboxylate CAS Name: 1-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methoxyphenyl)methylcarbamothioyl]piperidine-4-carboxylate Traditional Name: 1-(p-anisylthiocarbamoyl)isonipecotic acid ethyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H24N2O3S/c1-3-22-16(20)14-8-10-19(11-9-14)17(23)18-12-13-4-6-15(21-2)7-5-13/h4-7,14H,3,8-12H2,1-2H3,(H,18,23)