S-(2-acetamido-2-oxidanylidene-ethyl) (E)-3-phenylprop-2-enethioate

Systemtic Name: S-(2-acetamido-2-oxidanylidene-ethyl) (E)-3-phenylprop-2-enethioate Openeye Name: S-(2-acetamido-2-oxo-ethyl) (E)-3-phenylprop-2-enethioate CAS Name: (E)-3-phenyl-2-propenethioic acid S-(2-acetamido-2-oxoethyl) ester IUPAC Name: S-(2-acetamido-2-oxoethyl) (E)-3-phenylprop-2-enethioate Traditional Name: (E)-3-phenylprop-2-enethioic acid S-(2-acetamido-2-keto-ethyl) ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)NC(=O)CSC(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C13H13NO3S/c1-10(15)14-12(16)9-18-13(17)8-7-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,14,15,16)/b8-7+