N-(2-methylsulfanylethyl)-2-[(2R)-3-oxidanylidene-1-(pyridin-3-ylmethyl)piperazin-2-yl]ethanamide

Systemtic Name: N-(2-methylsulfanylethyl)-2-[(2R)-3-oxidanylidene-1-(pyridin-3-ylmethyl)piperazin-2-yl]ethanamide Openeye Name: N-(2-methylsulfanylethyl)-2-[(2R)-3-oxo-1-(3-pyridylmethyl)piperazin-2-yl]acetamide CAS Name: N-[2-(methylthio)ethyl]-2-[(2R)-3-oxo-1-(3-pyridinylmethyl)-2-piperazinyl]acetamide IUPAC Name: N-(2-methylsulfanylethyl)-2-[(2R)-3-oxo-1-(pyridin-3-ylmethyl)piperazin-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(3-pyridylmethyl)piperazin-2-yl]-N-[2-(methylthio)ethyl]acetamide Formula: C15H22N4O2S MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNC(=O)CC1C(=O)NCCN1CC2=CN=CC=C2

Isomeric SMILES

CSCCNC(=O)C[C@@H]1C(=O)NCCN1CC2=CN=CC=C2

InChI

InChI=1S/C15H22N4O2S/c1-22-8-6-17-14(20)9-13-15(21)18-5-7-19(13)11-12-3-2-4-16-10-12/h2-4,10,13H,5-9,11H2,1H3,(H,17,20)(H,18,21)/t13-/m1/s1