diethyl 5-[[4-[(5,8-dimethyl-6-oxidanylidene-7H-pteridin-2-yl)amino]phenyl]carbamoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[[4-[(5,8-dimethyl-6-oxidanylidene-7H-pteridin-2-yl)amino]phenyl]carbamoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]phenyl]carbamoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]anilino]-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[4-[(5,8-dimethyl-6-oxo-7H-pteridin-2-yl)amino]phenyl]carbamoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-[(6-keto-5,8-dimethyl-7H-pteridin-2-yl)amino]phenyl]carbamoylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C27H29N7O6 MolecularWeight: 547.56246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC=C4C(=N3)N(CC(=O)N4C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)NC3=NC=C4C(=N3)N(CC(=O)N4C)C)C(=O)OCC

InChI

InChI=1S/C27H29N7O6/c1-5-39-24(36)16-11-17(25(37)40-6-2)13-20(12-16)31-27(38)30-19-9-7-18(8-10-19)29-26-28-14-21-23(32-26)33(3)15-22(35)34(21)4/h7-14H,5-6,15H2,1-4H3,(H,28,29,32)(H2,30,31,38)