[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(phenylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: [4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(phenylsulfonyl)piperidin-3-yl]methanone Openeye Name: [1-(benzenesulfonyl)-3-piperidyl]-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: [1-(benzenesulfonyl)-3-piperidinyl]-[4-(4-methyl-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: [1-(benzenesulfonyl)piperidin-3-yl]-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (1-besyl-3-piperidyl)-[4-(4-methyl-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN(C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN(C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H28N4O3S2/c1-18-7-5-11-21-22(18)25-24(32-21)27-15-13-26(14-16-27)23(29)19-8-6-12-28(17-19)33(30,31)20-9-3-2-4-10-20/h2-5,7,9-11,19H,6,8,12-17H2,1H3