6-methylsulfanyl-2-[4-(phenylsulfonyl)piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 6-methylsulfanyl-2-[4-(phenylsulfonyl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-6-methylsulfanyl-1,3-benzothiazole CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-6-(methylthio)-1,3-benzothiazole IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-6-methylsulfanyl-1,3-benzothiazole Traditional Name: 2-(4-besylpiperazino)-6-(methylthio)-1,3-benzothiazole Formula: C18H19N3O2S3 MolecularWeight: 405.55736

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H19N3O2S3/c1-24-14-7-8-16-17(13-14)25-18(19-16)20-9-11-21(12-10-20)26(22,23)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3