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

Systemtic Name: 1-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]phenyl]urea Openeye Name: [4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]urea CAS Name: [4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]urea IUPAC Name: [4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)phenyl]urea Traditional Name: [4-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)phenyl]urea Formula: C14H14N6O3 MolecularWeight: 314.29936

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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)NC(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C14H14N6O3/c1-19-11-9(12(21)20(2)14(19)23)17-10(18-11)7-3-5-8(6-4-7)16-13(15)22/h3-6H,1-2H3,(H,17,18)(H3,15,16,22)