5-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenyl-benzenecarbonitrile

Systemtic Name: 5-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenyl-benzenecarbonitrile Openeye Name: 5-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenyl-benzonitrile CAS Name: 5-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenylbenzonitrile IUPAC Name: 5-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenylbenzonitrile Traditional Name: 5-[(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)methyl]-2-phenyl-benzonitrile Formula: C22H19N3O MolecularWeight: 341.40576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H19N3O/c23-14-17-12-15(10-11-18(17)16-6-2-1-3-7-16)13-21-24-20-9-5-4-8-19(20)22(26)25-21/h1-3,6-7,10-12H,4-5,8-9,13H2,(H,24,25,26)