(3R)-1-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl]piperidine-3-carboxamide CAS Name: (3R)-1-[2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[2-keto-2-[2-(p-tolylthio)ethylamino]ethyl]nipecotamide Formula: C17H25N3O2S MolecularWeight: 335.4643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CN2CCCC(C2)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CN2CCC[C@H](C2)C(=O)N

InChI

InChI=1S/C17H25N3O2S/c1-13-4-6-15(7-5-13)23-10-8-19-16(21)12-20-9-2-3-14(11-20)17(18)22/h4-7,14H,2-3,8-12H2,1H3,(H2,18,22)(H,19,21)/t14-/m1/s1