2-(4-chlorophenyl)sulfanyl-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 2-(4-chlorophenyl)sulfanyl-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 2-[(4-chlorophenyl)thio]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 2-(4-chlorophenyl)sulfanyl-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 2-[(4-chlorophenyl)thio]-1-(4-methylpiperazino)butan-1-one Formula: C15H21ClN2OS MolecularWeight: 312.85804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)C)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)C)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H21ClN2OS/c1-3-14(20-13-6-4-12(16)5-7-13)15(19)18-10-8-17(2)9-11-18/h4-7,14H,3,8-11H2,1-2H3