2-(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)ethanoic acid

Systemtic Name: 2-(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)ethanoic acid Openeye Name: 2-(3-cyclohexyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)acetic acid CAS Name: 2-(3-cyclohexyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)acetic acid IUPAC Name: 2-(3-cyclohexyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)acetic acid Traditional Name: 2-(3-cyclohexyl-4-keto-2-thioxo-1H-pyrimidin-5-yl)acetic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNC2=S)CC(=O)O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CNC2=S)CC(=O)O

InChI

InChI=1S/C12H16N2O3S/c15-10(16)6-8-7-13-12(18)14(11(8)17)9-4-2-1-3-5-9/h7,9H,1-6H2,(H,13,18)(H,15,16)