methyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-propan-2-yl-azanium

Systemtic Name: methyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)imidazol-4-yl]methyl]-propan-2-yl-azanium Openeye Name: (3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl-isopropyl-methyl-ammonium CAS Name: methyl-[[2-(2-methylpropylsulfonyl)-3-(phenylmethyl)-4-imidazolyl]methyl]-propan-2-ylammonium IUPAC Name: [3-benzyl-2-(2-methylpropylsulfonyl)imidazol-4-yl]methyl-methyl-propan-2-ylazanium Traditional Name: (3-benzyl-2-isobutylsulfonyl-imidazol-4-yl)methyl-isopropyl-methyl-ammonium Formula: C19H30N3O2S+ MolecularWeight: 364.5254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)C[NH+](C)C(C)C

Isomeric SMILES

CC(C)CS(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2)C[NH+](C)C(C)C

InChI

InChI=1S/C19H29N3O2S/c1-15(2)14-25(23,24)19-20-11-18(13-21(5)16(3)4)22(19)12-17-9-7-6-8-10-17/h6-11,15-16H,12-14H2,1-5H3/p+1