2-(4H-3,1-benzothiazin-2-ylsulfanyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=NC4=CC=CC=C4CS3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=NC4=CC=CC=C4CS3

InChI

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