3,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid

Systemtic Name: 3,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid Openeye Name: 3,6-dimethyl-2-thioxo-hexahydropyrimidine-4-carboxylic acid CAS Name: 3,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid IUPAC Name: 3,6-dimethyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid Traditional Name: 3,6-dimethyl-2-thioxo-hexahydropyrimidine-4-carboxylic acid Formula: C7H12N2O2S MolecularWeight: 188.24738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C(=S)N1)C)C(=O)O

Isomeric SMILES

CC1CC(N(C(=S)N1)C)C(=O)O

InChI

InChI=1S/C7H12N2O2S/c1-4-3-5(6(10)11)9(2)7(12)8-4/h4-5H,3H2,1-2H3,(H,8,12)(H,10,11)