[2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-azanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate

Systemtic Name: [2-[(4-iodanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 5-azanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate Openeye Name: [2-(4-iodo-2-methyl-anilino)-2-oxo-ethyl] 5-amino-2,4-dioxo-1H-pyrimidine-6-carboxylate CAS Name: 5-amino-2,4-dioxo-1H-pyrimidine-6-carboxylic acid [2-(4-iodo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-iodo-2-methylanilino)-2-oxoethyl] 5-amino-2,4-dioxo-1H-pyrimidine-6-carboxylate Traditional Name: 5-amino-2,4-diketo-1H-pyrimidine-6-carboxylic acid [2-(4-iodo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C14H13IN4O5 MolecularWeight: 444.18129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=C(C(=O)NC(=O)N2)N

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)COC(=O)C2=C(C(=O)NC(=O)N2)N

InChI

InChI=1S/C14H13IN4O5/c1-6-4-7(15)2-3-8(6)17-9(20)5-24-13(22)11-10(16)12(21)19-14(23)18-11/h2-4H,5,16H2,1H3,(H,17,20)(H2,18,19,21,23)