4,5-dimethyl-2-[4-(phenylsulfonyl)piperazin-1-yl]-1,3-benzothiazole

Systemtic Name: 4,5-dimethyl-2-[4-(phenylsulfonyl)piperazin-1-yl]-1,3-benzothiazole Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-4,5-dimethyl-1,3-benzothiazole CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-4,5-dimethyl-1,3-benzothiazole IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-4,5-dimethyl-1,3-benzothiazole Traditional Name: 2-(4-besylpiperazino)-4,5-dimethyl-1,3-benzothiazole Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)C

InChI

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