N-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: N-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: N-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)-4-imidazolyl]methyl]-N-methyl-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: N-[[3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [3-(cyclohexylmethyl)-2-(cyclopropylmethylsulfonyl)imidazol-4-yl]methyl-methyl-(2-pyrrolidin-1-ium-1-ylethyl)amine Formula: C22H39N4O2S+ MolecularWeight: 423.63566

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCCC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

Isomeric SMILES

CN(CC[NH+]1CCCC1)CC2=CN=C(N2CC3CCCCC3)S(=O)(=O)CC4CC4

InChI

InChI=1S/C22H38N4O2S/c1-24(13-14-25-11-5-6-12-25)17-21-15-23-22(29(27,28)18-20-9-10-20)26(21)16-19-7-3-2-4-8-19/h15,19-20H,2-14,16-18H2,1H3/p+1