S-(3-chloranyl-2-ethyl-2-methyl-4-oxidanylidene-chromen-3-yl)sulfanyl ethanethioate

Systemtic Name: S-(3-chloranyl-2-ethyl-2-methyl-4-oxidanylidene-chromen-3-yl)sulfanyl ethanethioate Openeye Name: S-(3-chloro-2-ethyl-2-methyl-4-oxo-chroman-3-yl)sulfanyl ethanethioate CAS Name: ethanethioic acid S-[(3-chloro-2-ethyl-2-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl)thio] ester IUPAC Name: S-(3-chloro-2-ethyl-2-methyl-4-oxochromen-3-yl)sulfanyl ethanethioate Traditional Name: ethanethioic acid S-[(3-chloro-2-ethyl-4-keto-2-methyl-chroman-3-yl)thio] ester Formula: C14H15ClO3S2 MolecularWeight: 330.8501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(=O)C2=CC=CC=C2O1)(SSC(=O)C)Cl)C

Isomeric SMILES

CCC1(C(C(=O)C2=CC=CC=C2O1)(SSC(=O)C)Cl)C

InChI

InChI=1S/C14H15ClO3S2/c1-4-13(3)14(15,20-19-9(2)16)12(17)10-7-5-6-8-11(10)18-13/h5-8H,4H2,1-3H3