2-[4-[(2-acetamido-5-azanyl-5-oxidanylidene-pentanoyl)amino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-[4-[(2-acetamido-5-azanyl-5-oxidanylidene-pentanoyl)amino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-[4-[(2-acetamido-5-amino-5-oxo-pentanoyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[4-[(2-acetamido-5-amino-1,5-dioxopentyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[4-[(2-acetamido-5-amino-5-oxopentanoyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-[4-[(2-acetamido-5-amino-5-keto-pentanoyl)amino]phenyl]-6-keto-1H-pyrimidine-5-carboxylic acid Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)N)C(=O)NC1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)O

Isomeric SMILES

CC(=O)NC(CCC(=O)N)C(=O)NC1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)O

InChI

InChI=1S/C18H19N5O6/c1-9(24)21-13(6-7-14(19)25)17(27)22-11-4-2-10(3-5-11)15-20-8-12(18(28)29)16(26)23-15/h2-5,8,13H,6-7H2,1H3,(H2,19,25)(H,21,24)(H,22,27)(H,28,29)(H,20,23,26)