dimethyl 2-[[4-[(2-azanyl-3-methyl-4-oxidanylidene-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate

Systemtic Name: dimethyl 2-[[4-[(2-azanyl-3-methyl-4-oxidanylidene-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioate Openeye Name: dimethyl 2-[[4-[(2-amino-3-methyl-4-oxo-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(2-amino-3-methyl-4-oxo-6-pteridinyl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[(2-amino-3-methyl-4-oxopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[(2-amino-4-keto-3-methyl-pteridin-6-yl)methylamino]benzoyl]amino]glutaric acid dimethyl ester Formula: C22H25N7O6 MolecularWeight: 483.4772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=NC(=CN=C2N=C1N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)OC)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=NC(=CN=C2N=C1N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)OC)C(=O)OC

InChI

InChI=1S/C22H25N7O6/c1-29-20(32)17-18(28-22(29)23)25-11-14(26-17)10-24-13-6-4-12(5-7-13)19(31)27-15(21(33)35-3)8-9-16(30)34-2/h4-7,11,15,24H,8-10H2,1-3H3,(H,27,31)(H2,23,25,28)