N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-oxidanylidenebenzo[g]quinazolin-3-yl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-oxidanylidenebenzo[g]quinazolin-3-yl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-oxobenzo[g]quinazolin-3-yl)acetamide CAS Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-oxo-3-benzo[g]quinazolinyl)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-oxobenzo[g]quinazolin-3-yl)acetamide Traditional Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(4-ketobenzo[g]quinazolin-3-yl)acetamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=NC3=CC4=CC=CC=C4C=C3C2=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=NC3=CC4=CC=CC=C4C=C3C2=O)C

InChI

InChI=1S/C25H22N4O2/c1-17-10-18(2)12-21(11-17)29(9-5-8-26)24(30)15-28-16-27-23-14-20-7-4-3-6-19(20)13-22(23)25(28)31/h3-4,6-7,10-14,16H,5,9,15H2,1-2H3