S-(3-chloranyl-2,2-dimethyl-4-oxidanylidene-chromen-3-yl)sulfanyl ethanethioate

Systemtic Name: S-(3-chloranyl-2,2-dimethyl-4-oxidanylidene-chromen-3-yl)sulfanyl ethanethioate Openeye Name: S-(3-chloro-2,2-dimethyl-4-oxo-chroman-3-yl)sulfanyl ethanethioate CAS Name: ethanethioic acid S-[(3-chloro-2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl)thio] ester IUPAC Name: S-(3-chloro-2,2-dimethyl-4-oxochromen-3-yl)sulfanyl ethanethioate Traditional Name: ethanethioic acid S-[(3-chloro-4-keto-2,2-dimethyl-chroman-3-yl)thio] ester Formula: C13H13ClO3S2 MolecularWeight: 316.82352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SSC1(C(=O)C2=CC=CC=C2OC1(C)C)Cl

Isomeric SMILES

CC(=O)SSC1(C(=O)C2=CC=CC=C2OC1(C)C)Cl

InChI

InChI=1S/C13H13ClO3S2/c1-8(15)18-19-13(14)11(16)9-6-4-5-7-10(9)17-12(13,2)3/h4-7H,1-3H3