4-[(2E)-2-[2-azanyl-4,6-bis(oxidanylidene)-5,8-dihydro-1H-pteridin-7-ylidene]ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[(2E)-2-[2-azanyl-4,6-bis(oxidanylidene)-5,8-dihydro-1H-pteridin-7-ylidene]ethanoyl]benzenecarbonitrile Openeye Name: 4-[(2E)-2-(2-amino-4,6-dioxo-5,8-dihydro-1H-pteridin-7-ylidene)acetyl]benzonitrile CAS Name: 4-[(2E)-2-(2-amino-4,6-dioxo-5,8-dihydro-1H-pteridin-7-ylidene)-1-oxoethyl]benzonitrile IUPAC Name: 4-[(2E)-2-(2-amino-4,6-dioxo-5,8-dihydro-1H-pteridin-7-ylidene)acetyl]benzonitrile Traditional Name: 4-[(2E)-2-(2-amino-4,6-diketo-5,8-dihydro-1H-pteridin-7-ylidene)acetyl]benzonitrile Formula: C15H10N6O3 MolecularWeight: 322.2783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)C=C2C(=O)NC3=C(N2)NC(=NC3=O)N

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)/C=C/2\C(=O)NC3=C(N2)NC(=NC3=O)N

InChI

InChI=1S/C15H10N6O3/c16-6-7-1-3-8(4-2-7)10(22)5-9-13(23)19-11-12(18-9)20-15(17)21-14(11)24/h1-5H,(H,19,23)(H4,17,18,20,21,24)/b9-5+