S-methyl (E)-5-(4-chlorophenyl)-3-oxidanylidene-pent-4-enethioate

Systemtic Name: S-methyl (E)-5-(4-chlorophenyl)-3-oxidanylidene-pent-4-enethioate Openeye Name: S-methyl (E)-5-(4-chlorophenyl)-3-oxo-pent-4-enethioate CAS Name: (E)-5-(4-chlorophenyl)-3-oxo-4-pentenethioic acid S-methyl ester IUPAC Name: S-methyl (E)-5-(4-chlorophenyl)-3-oxopent-4-enethioate Traditional Name: (E)-5-(4-chlorophenyl)-3-keto-pent-4-enethioic acid S-methyl ester Formula: C12H11ClO2S MolecularWeight: 254.73254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClO2S/c1-16-12(15)8-11(14)7-4-9-2-5-10(13)6-3-9/h2-7H,8H2,1H3/b7-4+