2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide CAS Name: 2-[(2-amino-2-oxoethyl)thio]-N-[2-(3-methylphenoxy)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]pyridine-3-carboxamide Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-N-[2-(3-methylphenoxy)ethyl]nicotinamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C2=C(N=CC=C2)SCC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C2=C(N=CC=C2)SCC(=O)N

InChI

InChI=1S/C17H19N3O3S/c1-12-4-2-5-13(10-12)23-9-8-19-16(22)14-6-3-7-20-17(14)24-11-15(18)21/h2-7,10H,8-9,11H2,1H3,(H2,18,21)(H,19,22)