3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[(3,4-dichlorophenyl)methylthio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C20H22Cl2N2OS MolecularWeight: 409.37248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCSCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCSCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N2OS/c21-18-7-6-16(14-19(18)22)15-26-13-8-20(25)24-11-9-23(10-12-24)17-4-2-1-3-5-17/h1-7,14H,8-13,15H2