2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenyl]guanidine

Systemtic Name: 2-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenyl]guanidine Openeye Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]guanidine CAS Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]guanidine IUPAC Name: 2-[4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]guanidine Traditional Name: 2-[4-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)phenyl]guanidine Formula: C14H15N7O2 MolecularWeight: 313.3146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)N=C(N)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=CC=C(C=C3)N=C(N)N

InChI

InChI=1S/C14H15N7O2/c1-20-11-9(12(22)21(2)14(20)23)18-10(19-11)7-3-5-8(6-4-7)17-13(15)16/h3-6H,1-2H3,(H,18,19)(H4,15,16,17)