1-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone

Systemtic Name: 1-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-(4-methylphenyl)sulfonyl-ethanone Openeye Name: 1-[4-[4-(3-bromophenyl)thiazol-2-yl]-1-piperidyl]-2-(p-tolylsulfonyl)ethanone CAS Name: 1-[4-[4-(3-bromophenyl)-2-thiazolyl]-1-piperidinyl]-2-(4-methylphenyl)sulfonylethanone IUPAC Name: 1-[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]-2-(4-methylphenyl)sulfonylethanone Traditional Name: 1-[4-[4-(3-bromophenyl)thiazol-2-yl]piperidino]-2-tosyl-ethanone Formula: C23H23BrN2O3S2 MolecularWeight: 519.47432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N2CCC(CC2)C3=NC(=CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H23BrN2O3S2/c1-16-5-7-20(8-6-16)31(28,29)15-22(27)26-11-9-17(10-12-26)23-25-21(14-30-23)18-3-2-4-19(24)13-18/h2-8,13-14,17H,9-12,15H2,1H3