6-aminocarbonyl-1-[2-[(2-methylphenyl)methylamino]ethyl]-2-oxidanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 6-aminocarbonyl-1-[2-[(2-methylphenyl)methylamino]ethyl]-2-oxidanylidene-pyrimidine-5-carboxylic acid Openeye Name: 6-carbamoyl-1-[2-(o-tolylmethylamino)ethyl]-2-oxo-pyrimidine-5-carboxylic acid CAS Name: 6-carbamoyl-1-[2-[(2-methylphenyl)methylamino]ethyl]-2-oxo-5-pyrimidinecarboxylic acid IUPAC Name: 6-carbamoyl-1-[2-[(2-methylphenyl)methylamino]ethyl]-2-oxopyrimidine-5-carboxylic acid Traditional Name: 6-carbamoyl-2-keto-1-[2-[(2-methylbenzyl)amino]ethyl]pyrimidine-5-carboxylic acid Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNCCN2C(=C(C=NC2=O)C(=O)O)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1CNCCN2C(=C(C=NC2=O)C(=O)O)C(=O)N

InChI

InChI=1S/C16H18N4O4/c1-10-4-2-3-5-11(10)8-18-6-7-20-13(14(17)21)12(15(22)23)9-19-16(20)24/h2-5,9,18H,6-8H2,1H3,(H2,17,21)(H,22,23)