3-cyano-3-(2-methylphenyl)-N-(4-nitro-1,3-thiazol-2-yl)-2-oxidanylidene-propanamide

Systemtic Name: 3-cyano-3-(2-methylphenyl)-N-(4-nitro-1,3-thiazol-2-yl)-2-oxidanylidene-propanamide Openeye Name: 3-cyano-N-(4-nitrothiazol-2-yl)-3-(o-tolyl)-2-oxo-propanamide CAS Name: 3-cyano-3-(2-methylphenyl)-N-(4-nitro-2-thiazolyl)-2-oxopropanamide IUPAC Name: 3-cyano-3-(2-methylphenyl)-N-(4-nitro-1,3-thiazol-2-yl)-2-oxopropanamide Traditional Name: 3-cyano-2-keto-N-(4-nitrothiazol-2-yl)-3-(o-tolyl)propionamide Formula: C14H10N4O4S MolecularWeight: 330.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C#N)C(=O)C(=O)NC2=NC(=CS2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C(C#N)C(=O)C(=O)NC2=NC(=CS2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O4S/c1-8-4-2-3-5-9(8)10(6-15)12(19)13(20)17-14-16-11(7-23-14)18(21)22/h2-5,7,10H,1H3,(H,16,17,20)