1-chloranyl-4-methyl-3-phenylsulfanyl-pentan-2-one

Systemtic Name: 1-chloranyl-4-methyl-3-phenylsulfanyl-pentan-2-one Openeye Name: 1-chloro-4-methyl-3-phenylsulfanyl-pentan-2-one CAS Name: 1-chloro-4-methyl-3-(phenylthio)-2-pentanone IUPAC Name: 1-chloro-4-methyl-3-phenylsulfanylpentan-2-one Traditional Name: 1-chloro-4-methyl-3-(phenylthio)pentan-2-one Formula: C12H15ClOS MolecularWeight: 242.7649

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)CCl)SC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)CCl)SC1=CC=CC=C1

InChI

InChI=1S/C12H15ClOS/c1-9(2)12(11(14)8-13)15-10-6-4-3-5-7-10/h3-7,9,12H,8H2,1-2H3