6-methyl-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole hydrochloride

Systemtic Name: 6-methyl-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole hydrochloride Openeye Name: 6-methyl-2-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,3-benzothiazole hydrochloride CAS Name: 6-methyl-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1,3-benzothiazole hydrochloride IUPAC Name: 6-methyl-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,3-benzothiazole hydrochloride Traditional Name: 6-methyl-2-(4-tosylpiperazino)-1,3-benzothiazole hydrochloride Formula: C19H22ClN3O2S2 MolecularWeight: 423.97988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C.Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)C.Cl

InChI

InChI=1S/C19H21N3O2S2.ClH/c1-14-3-6-16(7-4-14)26(23,24)22-11-9-21(10-12-22)19-20-17-8-5-15(2)13-18(17)25-19;/h3-8,13H,9-12H2,1-2H3;1H