(3S)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-6-oxidanylidene-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-6-oxo-1-[2-(2-pyridyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-6-oxo-1-[2-(2-pyridinyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-6-oxo-1-(2-pyridin-2-ylethyl)piperidine-3-carboxamide Traditional Name: (3S)-6-keto-N-[2-[(1-methylimidazol-2-yl)thio]ethyl]-1-[2-(2-pyridyl)ethyl]nipecotamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC(=O)C2CCC(=O)N(C2)CCC3=CC=CC=N3

Isomeric SMILES

CN1C=CN=C1SCCNC(=O)[C@H]2CCC(=O)N(C2)CCC3=CC=CC=N3

InChI

InChI=1S/C19H25N5O2S/c1-23-12-9-22-19(23)27-13-10-21-18(26)15-5-6-17(25)24(14-15)11-7-16-4-2-3-8-20-16/h2-4,8-9,12,15H,5-7,10-11,13-14H2,1H3,(H,21,26)/t15-/m0/s1