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

Systemtic Name: 4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-(3-methoxypropylamino)-2-oxo-ethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-[[2-(3-methoxypropylamino)-2-oxoethyl]thio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-[2-(3-methoxypropylamino)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-4-[[2-keto-2-(3-methoxypropylamino)ethyl]thio]-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC(=O)NCCCOC)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC(=O)NCCCOC)C(=O)O

InChI

InChI=1S/C12H17N3O5S/c1-7-9(11(17)18)10(15-12(19)14-7)21-6-8(16)13-4-3-5-20-2/h3-6H2,1-2H3,(H,13,16)(H,17,18)(H,14,15,19)