3-[3-(2-cyanoethyl)-4-oxidanylidene-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propanenitrile

Systemtic Name: 3-[3-(2-cyanoethyl)-4-oxidanylidene-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propanenitrile Openeye Name: 3-[3-(2-cyanoethyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propanenitrile CAS Name: 3-[3-(2-cyanoethyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propanenitrile IUPAC Name: 3-[3-(2-cyanoethyl)-4-oxo-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propanenitrile Traditional Name: 3-[3-(2-cyanoethyl)-4-keto-2-phenyl-5,6,7,8-tetrahydro-2H-quinazolin-4a-yl]propionitrile Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(=NC(N(C2=O)CCC#N)C3=CC=CC=C3)C1)CCC#N

Isomeric SMILES

C1CCC2(C(=NC(N(C2=O)CCC#N)C3=CC=CC=C3)C1)CCC#N

InChI

InChI=1S/C20H22N4O/c21-13-6-12-20-11-5-4-10-17(20)23-18(16-8-2-1-3-9-16)24(19(20)25)15-7-14-22/h1-3,8-9,18H,4-7,10-12,15H2