2-acetamido-4-oxidanylidene-5-phenyl-hexanethioic S-acid

Systemtic Name: 2-acetamido-4-oxidanylidene-5-phenyl-hexanethioic S-acid Openeye Name: 2-acetamido-4-oxo-5-phenyl-hexanethioic S-acid CAS Name: 2-acetamido-4-oxo-5-phenylhexanethioic S-acid IUPAC Name: 2-acetamido-4-oxo-5-phenylhexanethioic S-acid Traditional Name: 2-acetamido-4-keto-5-phenyl-hexanethioic S-acid Formula: C14H17NO3S MolecularWeight: 279.35468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO3S/c1-9(11-6-4-3-5-7-11)13(17)8-12(14(18)19)15-10(2)16/h3-7,9,12H,8H2,1-2H3,(H,15,16)(H,18,19)