1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-[(4-chlorophenyl)methylsulfanyl]propan-1-one

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-[(4-chlorophenyl)methylsulfanyl]propan-1-one Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-[(4-chlorophenyl)methylsulfanyl]propan-1-one CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-[(4-chlorophenyl)methylthio]-1-propanone IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[(4-chlorophenyl)methylsulfanyl]propan-1-one Traditional Name: 3-[(4-chlorobenzyl)thio]-1-[4-(5-chloro-2-methyl-phenyl)piperazino]propan-1-one Formula: C21H24Cl2N2OS MolecularWeight: 423.39906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24Cl2N2OS/c1-16-2-5-19(23)14-20(16)24-9-11-25(12-10-24)21(26)8-13-27-15-17-3-6-18(22)7-4-17/h2-7,14H,8-13,15H2,1H3