3-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-[4-(3-chlorophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-[4-(3-chlorophenyl)piperazino]propan-1-one Formula: C20H20ClN3OS2 MolecularWeight: 417.9753

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20ClN3OS2/c21-15-4-3-5-16(14-15)23-9-11-24(12-10-23)19(25)8-13-26-20-22-17-6-1-2-7-18(17)27-20/h1-7,14H,8-13H2