1-[1-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]piperidin-3-yl]ethanone

Systemtic Name: 1-[1-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]piperidin-3-yl]ethanone Openeye Name: 1-[1-[(3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl]-3-piperidyl]ethanone CAS Name: 1-[1-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl]-3-piperidinyl]ethanone IUPAC Name: 1-[1-[[3-benzyl-2-(2-methylpropylsulfonyl)imidazol-4-yl]methyl]piperidin-3-yl]ethanone Traditional Name: 1-[1-[(3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl]-3-piperidyl]ethanone Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)CN3CCCC(C3)C(=O)C

Isomeric SMILES

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)CN3CCCC(C3)C(=O)C

InChI

InChI=1S/C22H31N3O3S/c1-17(2)16-29(27,28)22-23-12-21(25(22)13-19-8-5-4-6-9-19)15-24-11-7-10-20(14-24)18(3)26/h4-6,8-9,12,17,20H,7,10-11,13-16H2,1-3H3