2-methylsulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[2-oxidanylidene-2-(propylamino)ethyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[2-oxo-2-(propylamino)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-3-carboxamide Traditional Name: N-[2-keto-2-(propylamino)ethyl]-2-(methylthio)nicotinamide Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=C(N=CC=C1)SC

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=C(N=CC=C1)SC

InChI

InChI=1S/C12H17N3O2S/c1-3-6-13-10(16)8-15-11(17)9-5-4-7-14-12(9)18-2/h4-5,7H,3,6,8H2,1-2H3,(H,13,16)(H,15,17)