6-methyl-4-(4-oxidanylcyclohex-2-en-1-yl)-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-(4-oxidanylcyclohex-2-en-1-yl)-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-(4-hydroxycyclohex-2-en-1-yl)-6-methyl-2-thioxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-(4-hydroxy-1-cyclohex-2-enyl)-6-methyl-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-(4-hydroxycyclohex-2-en-1-yl)-6-methyl-2-sulfanylidene-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-(4-hydroxycyclohex-2-en-1-yl)-6-methyl-2-thioxo-1H-pyrimidine-5-carboxylic acid Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=S)N1)C2CCC(C=C2)O)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=S)N1)C2CCC(C=C2)O)C(=O)O

InChI

InChI=1S/C12H14N2O3S/c1-6-9(11(16)17)10(14-12(18)13-6)7-2-4-8(15)5-3-7/h2,4,7-8,15H,3,5H2,1H3,(H,16,17)(H,13,14,18)