4-[3-(aminocarbonylamino)-3-oxidanylidene-propyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[3-(aminocarbonylamino)-3-oxidanylidene-propyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-(3-oxo-3-ureido-propyl)sulfanyl-1H-pyrimidine-5-carboxylic acid CAS Name: 4-[[3-(carbamoylamino)-3-oxopropyl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-[3-(carbamoylamino)-3-oxopropyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-4-[(3-keto-3-ureido-propyl)thio]-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C10H12N4O5S MolecularWeight: 300.29108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCCC(=O)NC(=O)N)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCCC(=O)NC(=O)N)C(=O)O

InChI

InChI=1S/C10H12N4O5S/c1-4-6(8(16)17)7(14-10(19)12-4)20-3-2-5(15)13-9(11)18/h2-3H2,1H3,(H,16,17)(H,12,14,19)(H3,11,13,15,18)