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

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-N-(o-tolylmethyl)pyridine-3-carboxamide CAS Name: 2-[(2-amino-2-oxoethyl)thio]-N-[(2-methylphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-N-(2-methylbenzyl)nicotinamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC(=O)N

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=C(N=CC=C2)SCC(=O)N

InChI

InChI=1S/C16H17N3O2S/c1-11-5-2-3-6-12(11)9-19-15(21)13-7-4-8-18-16(13)22-10-14(17)20/h2-8H,9-10H2,1H3,(H2,17,20)(H,19,21)