4-methyl-2-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 4-methyl-2-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 4-methyl-2-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole CAS Name: 4-methyl-2-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 4-methyl-2-[4-(4-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-1,3-benzothiazole Traditional Name: 2-[4-(4-mesyl-1,3-benzothiazol-2-yl)piperazino]-4-methyl-1,3-benzothiazole Formula: C20H20N4O2S3 MolecularWeight: 444.5934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C4=NC5=C(S4)C=CC=C5S(=O)(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C4=NC5=C(S4)C=CC=C5S(=O)(=O)C

InChI

InChI=1S/C20H20N4O2S3/c1-13-5-3-6-14-17(13)21-19(27-14)23-9-11-24(12-10-23)20-22-18-15(28-20)7-4-8-16(18)29(2,25)26/h3-8H,9-12H2,1-2H3