1-(3-chlorophenyl)-2-sulfanyl-ethanone; methylbenzene

Systemtic Name: 1-(3-chlorophenyl)-2-sulfanyl-ethanone; methylbenzene Openeye Name: 1-(3-chlorophenyl)-2-sulfanyl-ethanone; toluene CAS Name: 1-(3-chlorophenyl)-2-mercaptoethanone; toluene IUPAC Name: 1-(3-chlorophenyl)-2-sulfanylethanone; toluene Traditional Name: 1-(3-chlorophenyl)-2-mercapto-ethanone; toluene Formula: C15H15ClOS MolecularWeight: 278.797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1=CC(=CC(=C1)Cl)C(=O)CS

Isomeric SMILES

CC1=CC=CC=C1.C1=CC(=CC(=C1)Cl)C(=O)CS

InChI

InChI=1S/C8H7ClOS.C7H8/c9-7-3-1-2-6(4-7)8(10)5-11;1-7-5-3-2-4-6-7/h1-4,11H,5H2;2-6H,1H3