(E)-2-cyano-N-methyl-3-(4-methylphenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-methyl-3-(4-methylphenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-N-methyl-3-(4-methylphenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-methyl-3-(4-methylphenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-3-(p-tolyl)acrylamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H18N4O2/c1-14-7-9-15(10-8-14)11-16(12-22)21(27)25(2)13-19-23-18-6-4-3-5-17(18)20(26)24-19/h3-11H,13H2,1-2H3,(H,23,24,26)/b16-11+