4-[2-tert-butyl-8-(4-methoxyphenyl)pyrido[4,3-d]pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-tert-butyl-8-(4-methoxyphenyl)pyrido[4,3-d]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[2-tert-butyl-8-(4-methoxyphenyl)pyrido[4,3-d]pyrimidin-4-yl]benzonitrile CAS Name: 4-[2-tert-butyl-8-(4-methoxyphenyl)-4-pyrido[4,3-d]pyrimidinyl]benzonitrile IUPAC Name: 4-[2-tert-butyl-8-(4-methoxyphenyl)pyrido[4,3-d]pyrimidin-4-yl]benzonitrile Traditional Name: 4-[2-tert-butyl-8-(4-methoxyphenyl)pyrido[4,3-d]pyrimidin-4-yl]benzonitrile Formula: C25H22N4O MolecularWeight: 394.46838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(C=NC=C2C(=N1)C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)C1=NC2=C(C=NC=C2C(=N1)C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H22N4O/c1-25(2,3)24-28-22(18-7-5-16(13-26)6-8-18)21-15-27-14-20(23(21)29-24)17-9-11-19(30-4)12-10-17/h5-12,14-15H,1-4H3