2-[[5-[(2,7-dimethyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-methyl-amino]pyridin-2-yl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[5-[(2,7-dimethyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-methyl-amino]pyridin-2-yl]carbonylamino]pentanedioic acid Openeye Name: 2-[[5-[(2,7-dimethyl-4-oxo-1H-quinazolin-6-yl)methyl-methyl-amino]pyridine-2-carbonyl]amino]pentanedioic acid CAS Name: 2-[[[5-[(2,7-dimethyl-4-oxo-1H-quinazolin-6-yl)methyl-methylamino]-2-pyridinyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[5-[(2,7-dimethyl-4-oxo-1H-quinazolin-6-yl)methyl-methylamino]pyridine-2-carbonyl]amino]pentanedioic acid Traditional Name: 2-[[5-[(4-keto-2,7-dimethyl-1H-quinazolin-6-yl)methyl-methyl-amino]picolinoyl]amino]glutaric acid Formula: C23H25N5O6 MolecularWeight: 467.4745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)NC(=NC2=O)C)CN(C)C3=CN=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)NC(=NC2=O)C)CN(C)C3=CN=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C23H25N5O6/c1-12-8-19-16(21(31)26-13(2)25-19)9-14(12)11-28(3)15-4-5-17(24-10-15)22(32)27-18(23(33)34)6-7-20(29)30/h4-5,8-10,18H,6-7,11H2,1-3H3,(H,27,32)(H,29,30)(H,33,34)(H,25,26,31)