N-(4-methyl-2-sulfanyl-phenyl)-3-oxidanylidene-butanamide

Systemtic Name: N-(4-methyl-2-sulfanyl-phenyl)-3-oxidanylidene-butanamide Openeye Name: N-(4-methyl-2-sulfanyl-phenyl)-3-oxo-butanamide CAS Name: N-(2-mercapto-4-methylphenyl)-3-oxobutanamide IUPAC Name: N-(4-methyl-2-sulfanylphenyl)-3-oxobutanamide Traditional Name: 3-keto-N-(2-mercapto-4-methyl-phenyl)butyramide Formula: C11H13NO2S MolecularWeight: 223.29142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CC(=O)C)S

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CC(=O)C)S

InChI

InChI=1S/C11H13NO2S/c1-7-3-4-9(10(15)5-7)12-11(14)6-8(2)13/h3-5,15H,6H2,1-2H3,(H,12,14)