2-[4-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]phenyl]-2-oxidanylidene-ethanal

Systemtic Name: 2-[4-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]phenyl]-2-oxidanylidene-ethanal Openeye Name: 2-[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]-2-oxo-acetaldehyde CAS Name: 2-[4-[(2,4-diamino-6-pteridinyl)methylamino]phenyl]-2-oxoacetaldehyde IUPAC Name: 2-[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]-2-oxoacetaldehyde Traditional Name: 2-[4-[(2,4-diaminopteridin-6-yl)methylamino]phenyl]-2-keto-acetaldehyde Formula: C15H13N7O2 MolecularWeight: 323.30942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)C=O)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N

InChI

InChI=1S/C15H13N7O2/c16-13-12-14(22-15(17)21-13)19-6-10(20-12)5-18-9-3-1-8(2-4-9)11(24)7-23/h1-4,6-7,18H,5H2,(H4,16,17,19,21,22)