dimethyl 2-[[4-[(2-azanylidene-1,3-dimethyl-4-oxidanylidene-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate

Systemtic Name: dimethyl 2-[[4-[(2-azanylidene-1,3-dimethyl-4-oxidanylidene-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate Openeye Name: dimethyl 2-[[4-[(2-imino-1,3-dimethyl-4-oxo-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(2-imino-1,3-dimethyl-4-oxo-6-pteridinyl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[(2-imino-1,3-dimethyl-4-oxopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[(2-imino-4-keto-1,3-dimethyl-pteridin-6-yl)methylamino]benzoyl]amino]glutaric acid dimethyl ester Formula: C23H27N7O6 MolecularWeight: 497.50378

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(N=C2C(=O)N(C1=N)C)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)OC)C(=O)OC

Isomeric SMILES

CN1C2=NC=C(N=C2C(=O)N(C1=N)C)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)OC)C(=O)OC

InChI

InChI=1S/C23H27N7O6/c1-29-19-18(21(33)30(2)23(29)24)27-15(12-26-19)11-25-14-7-5-13(6-8-14)20(32)28-16(22(34)36-4)9-10-17(31)35-3/h5-8,12,16,24-25H,9-11H2,1-4H3,(H,28,32)