(Z)-2-(4-oxidanylidene-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (Z)-2-(4-oxidanylidene-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enenitrile Openeye Name: (Z)-2-(4-oxo-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: (Z)-2-(4-oxo-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: (Z)-2-(4-oxo-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]prop-2-enenitrile Traditional Name: (Z)-2-(4-keto-4aH-quinazolin-2-yl)-3-[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]acrylonitrile Formula: C29H23N5O2 MolecularWeight: 473.52522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C3=NC(=O)C4C=CC=CC4=N3)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C(/C#N)\C3=NC(=O)C4C=CC=CC4=N3)C5=CC=CC=C5

InChI

InChI=1S/C29H23N5O2/c1-2-15-36-24-12-8-9-20(17-24)27-22(19-34(33-27)23-10-4-3-5-11-23)16-21(18-30)28-31-26-14-7-6-13-25(26)29(35)32-28/h3-14,16-17,19,25H,2,15H2,1H3/b21-16-