(4-chlorophenyl)-[4-(2-sulfanylpentan-2-yl)phenyl]methanone

Systemtic Name: (4-chlorophenyl)-[4-(2-sulfanylpentan-2-yl)phenyl]methanone Openeye Name: (4-chlorophenyl)-[4-(1-methyl-1-sulfanyl-butyl)phenyl]methanone CAS Name: (4-chlorophenyl)-[4-(2-mercaptopentan-2-yl)phenyl]methanone IUPAC Name: (4-chlorophenyl)-[4-(2-sulfanylpentan-2-yl)phenyl]methanone Traditional Name: (4-chlorophenyl)-[4-(1-mercapto-1-methyl-butyl)phenyl]methanone Formula: C18H19ClOS MolecularWeight: 318.86086

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)S

Isomeric SMILES

CCCC(C)(C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl)S

InChI

InChI=1S/C18H19ClOS/c1-3-12-18(2,21)15-8-4-13(5-9-15)17(20)14-6-10-16(19)11-7-14/h4-11,21H,3,12H2,1-2H3