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

Systemtic Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-methylsulfonyl-1,3-benzothiazole Openeye Name: 6-methylsulfonyl-2-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-6-methylsulfonyl-1,3-benzothiazole IUPAC Name: 2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-methylsulfonyl-1,3-benzothiazole Traditional Name: 6-mesyl-2-(4-tosylpiperazino)-1,3-benzothiazole Formula: C19H21N3O4S3 MolecularWeight: 451.58274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4S3/c1-14-3-5-15(6-4-14)29(25,26)22-11-9-21(10-12-22)19-20-17-8-7-16(28(2,23)24)13-18(17)27-19/h3-8,13H,9-12H2,1-2H3