4-bromanyl-2-ethyl-N-[4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-2-ethyl-N-[4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]benzenesulfonamide Openeye Name: 4-bromo-2-ethyl-N-[4-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-4-piperidyl]benzenesulfonamide CAS Name: 4-bromo-2-ethyl-N-[4-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-bromo-2-ethyl-N-[4-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]piperidin-4-yl]benzenesulfonamide Traditional Name: 4-bromo-2-ethyl-N-[4-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]-4-piperidyl]benzenesulfonamide Formula: C26H35BrN4O3S MolecularWeight: 563.5501

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2(CCNCC2)C(=O)N3CCN(C(C3)C)C4=CC=CC(=C4)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2(CCNCC2)C(=O)N3CCN(C(C3)C)C4=CC=CC(=C4)C

InChI

InChI=1S/C26H35BrN4O3S/c1-4-21-17-22(27)8-9-24(21)35(33,34)29-26(10-12-28-13-11-26)25(32)30-14-15-31(20(3)18-30)23-7-5-6-19(2)16-23/h5-9,16-17,20,28-29H,4,10-15,18H2,1-3H3