methyl 4-[[4-[(5,8-dimethyl-6-oxidanylidene-7H-pteridin-2-yl)amino]phenyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-[(5,8-dimethyl-6-oxidanylidene-7H-pteridin-2-yl)amino]phenyl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]phenyl]carbamoyl]benzoate CAS Name: 4-[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]phenyl]carbamoyl]benzoate Traditional Name: 4-[[4-[(6-keto-5,8-dimethyl-7H-pteridin-2-yl)amino]phenyl]carbamoyl]benzoic acid methyl ester Formula: C23H22N6O4 MolecularWeight: 446.45858

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C2=CN=C(N=C21)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)OC)C

Isomeric SMILES

CN1CC(=O)N(C2=CN=C(N=C21)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)OC)C

InChI

InChI=1S/C23H22N6O4/c1-28-13-19(30)29(2)18-12-24-23(27-20(18)28)26-17-10-8-16(9-11-17)25-21(31)14-4-6-15(7-5-14)22(32)33-3/h4-12H,13H2,1-3H3,(H,25,31)(H,24,26,27)