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

Systemtic Name: 2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methylsulfonyl-1,3-benzothiazole Openeye Name: 2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methylsulfonyl-1,3-benzothiazole CAS Name: 4-methylsulfonyl-2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-1,3-benzothiazole IUPAC Name: 2-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-methylsulfonyl-1,3-benzothiazole Traditional Name: 4-mesyl-2-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]piperazino]-1,3-benzothiazole Formula: C20H20N4O2S4 MolecularWeight: 476.6584

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=CC=C5S(=O)(=O)C

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4=NC5=C(S4)C=CC=C5S(=O)(=O)C

InChI

InChI=1S/C20H20N4O2S4/c1-27-13-6-7-14-16(12-13)29-19(21-14)23-8-10-24(11-9-23)20-22-18-15(28-20)4-3-5-17(18)30(2,25)26/h3-7,12H,8-11H2,1-2H3