dimethyl 2-[[4-[2-[(2-acetamido-6-oxidanylidene-1H-pyrimidin-5-yl)-methanoyl-amino]ethyl-methanoyl-amino]phenyl]carbonylamino]pentanedioate

Systemtic Name: dimethyl 2-[[4-[2-[(2-acetamido-6-oxidanylidene-1H-pyrimidin-5-yl)-methanoyl-amino]ethyl-methanoyl-amino]phenyl]carbonylamino]pentanedioate Openeye Name: dimethyl 2-[[4-[2-[(2-acetamido-6-oxo-1H-pyrimidin-5-yl)-formyl-amino]ethyl-formyl-amino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[2-[(2-acetamido-6-oxo-1H-pyrimidin-5-yl)-formylamino]ethyl-formylamino]phenyl]-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[2-[(2-acetamido-6-oxo-1H-pyrimidin-5-yl)-formylamino]ethyl-formylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[2-[(2-acetamido-6-keto-1H-pyrimidin-5-yl)-formyl-amino]ethyl-formyl-amino]benzoyl]amino]glutaric acid dimethyl ester Formula: C24H28N6O9 MolecularWeight: 544.51392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(C(=O)N1)N(CCN(C=O)C2=CC=C(C=C2)C(=O)NC(CCC(=O)OC)C(=O)OC)C=O

Isomeric SMILES

CC(=O)NC1=NC=C(C(=O)N1)N(CCN(C=O)C2=CC=C(C=C2)C(=O)NC(CCC(=O)OC)C(=O)OC)C=O

InChI

InChI=1S/C24H28N6O9/c1-15(33)26-24-25-12-19(22(36)28-24)30(14-32)11-10-29(13-31)17-6-4-16(5-7-17)21(35)27-18(23(37)39-3)8-9-20(34)38-2/h4-7,12-14,18H,8-11H2,1-3H3,(H,27,35)(H2,25,26,28,33,36)