(3S)-1-[2-(4-methoxyphenyl)ethylcarbamothioyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-(4-methoxyphenyl)ethylcarbamothioyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(4-methoxyphenyl)ethylcarbamothioyl]piperidine-3-carboxamide CAS Name: (3S)-1-[[2-(4-methoxyphenyl)ethylamino]-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(4-methoxyphenyl)ethylcarbamothioyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[2-(4-methoxyphenyl)ethylthiocarbamoyl]nipecotamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)N2CCCC(C2)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)N2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C16H23N3O2S/c1-21-14-6-4-12(5-7-14)8-9-18-16(22)19-10-2-3-13(11-19)15(17)20/h4-7,13H,2-3,8-11H2,1H3,(H2,17,20)(H,18,22)/t13-/m0/s1