2-azanyl-5-cyano-N-(3-methylphenyl)-6-prop-2-enylsulfanyl-pyridine-3-carboxamide

Systemtic Name: 2-azanyl-5-cyano-N-(3-methylphenyl)-6-prop-2-enylsulfanyl-pyridine-3-carboxamide Openeye Name: 6-allylsulfanyl-2-amino-5-cyano-N-(m-tolyl)pyridine-3-carboxamide CAS Name: 2-amino-5-cyano-N-(3-methylphenyl)-6-(prop-2-enylthio)-3-pyridinecarboxamide IUPAC Name: 2-amino-5-cyano-N-(3-methylphenyl)-6-prop-2-enylsulfanylpyridine-3-carboxamide Traditional Name: 6-(allylthio)-2-amino-5-cyano-N-(m-tolyl)nicotinamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=C(N=C(C(=C2)C#N)SCC=C)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=C(N=C(C(=C2)C#N)SCC=C)N

InChI

InChI=1S/C17H16N4OS/c1-3-7-23-17-12(10-18)9-14(15(19)21-17)16(22)20-13-6-4-5-11(2)8-13/h3-6,8-9H,1,7H2,2H3,(H2,19,21)(H,20,22)