[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: [4-(1,3-benzothiazol-2-yl)-1-piperidyl]-[1-(p-tolylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: [4-(1,3-benzothiazol-2-yl)piperidino]-(1-tosyl-4-piperidyl)methanone Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H29N3O3S2/c1-18-6-8-21(9-7-18)33(30,31)28-16-12-20(13-17-28)25(29)27-14-10-19(11-15-27)24-26-22-4-2-3-5-23(22)32-24/h2-9,19-20H,10-17H2,1H3