4-[[4-azanylidene-3-[(4-methoxyphenyl)amino]pyrimido[5,4-d]pyrimidin-8-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanylidene-3-[(4-methoxyphenyl)amino]pyrimido[5,4-d]pyrimidin-8-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-imino-3-(4-methoxyanilino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile CAS Name: 4-[[4-imino-3-(4-methoxyanilino)-8-pyrimido[5,4-d]pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-imino-3-(4-methoxyanilino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile Traditional Name: 4-[[4-imino-3-(p-anisidino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile Formula: C20H16N8O MolecularWeight: 384.39404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NN2C=NC3=C(C2=N)N=CN=C3NC4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NN2C=NC3=C(C2=N)N=CN=C3NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H16N8O/c1-29-16-8-6-15(7-9-16)27-28-12-25-18-17(19(28)22)23-11-24-20(18)26-14-4-2-13(10-21)3-5-14/h2-9,11-12,22,27H,1H3,(H,23,24,26)