4-[3-[[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 4-[3-[[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]-1,3-dihydrobenzimidazol-2-one Openeye Name: 4-[3-[[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]-1,3-dihydrobenzimidazol-2-one CAS Name: 4-[3-[[1-(4-bromo-2-ethylphenyl)sulfonyl-4-piperidinyl]methylamino]-2-hydroxypropoxy]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 4-[3-[[1-(4-bromo-2-ethylphenyl)sulfonylpiperidin-4-yl]methylamino]-2-hydroxypropoxy]-1,3-dihydrobenzimidazol-2-one Traditional Name: 4-[3-[[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]-1,3-dihydrobenzimidazol-2-one Formula: C24H31BrN4O5S MolecularWeight: 567.49574

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=CC4=C3NC(=O)N4)O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=CC4=C3NC(=O)N4)O

InChI

InChI=1S/C24H31BrN4O5S/c1-2-17-12-18(25)6-7-22(17)35(32,33)29-10-8-16(9-11-29)13-26-14-19(30)15-34-21-5-3-4-20-23(21)28-24(31)27-20/h3-7,12,16,19,26,30H,2,8-11,13-15H2,1H3,(H2,27,28,31)