4-[[4-(phenylmethoxyamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-(phenylmethoxyamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(benzyloxyamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile CAS Name: 4-[[4-(phenylmethoxyamino)-8-pyrimido[5,4-d]pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(phenylmethoxyamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile Traditional Name: 4-[[4-(benzoxyamino)pyrimido[5,4-d]pyrimidin-8-yl]amino]benzonitrile Formula: C20H15N7O MolecularWeight: 369.3794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CONC2=NC=NC3=C2N=CN=C3NC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CONC2=NC=NC3=C2N=CN=C3NC4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H15N7O/c21-10-14-6-8-16(9-7-14)26-19-17-18(23-12-24-19)20(25-13-22-17)27-28-11-15-4-2-1-3-5-15/h1-9,12-13H,11H2,(H,22,25,27)(H,23,24,26)