4-[4-(dimethylcarbamothioyl)phenyl]-3-methyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(dimethylcarbamothioyl)phenyl]-3-methyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(dimethylcarbamothioyl)phenyl]-3-methyl-4-oxo-butanoic acid CAS Name: 4-[4-[dimethylamino(sulfanylidene)methyl]phenyl]-3-methyl-4-oxobutanoic acid IUPAC Name: 4-[4-(dimethylcarbamothioyl)phenyl]-3-methyl-4-oxobutanoic acid Traditional Name: 4-[4-(dimethylthiocarbamoyl)phenyl]-4-keto-3-methyl-butyric acid Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)C(=S)N(C)C

Isomeric SMILES

CC(CC(=O)O)C(=O)C1=CC=C(C=C1)C(=S)N(C)C

InChI

InChI=1S/C14H17NO3S/c1-9(8-12(16)17)13(18)10-4-6-11(7-5-10)14(19)15(2)3/h4-7,9H,8H2,1-3H3,(H,16,17)