2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-(4-benzylpiperazin-1-yl)ethanone CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-1-(4-benzylpiperazin-1-yl)ethanone Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-1-(4-benzylpiperazino)ethanone Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3OS2/c25-21(16-26-15-20-22-18-8-4-5-9-19(18)27-20)24-12-10-23(11-13-24)14-17-6-2-1-3-7-17/h1-9H,10-16H2