2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[[2-(cyclopropylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl]piperazin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C20H36N5O4S+ MolecularWeight: 442.59594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)CC2=CN=C(N2CCOC)S(=O)(=O)CC3CC3

InChI

InChI=1S/C20H35N5O4S/c1-16(2)22-19(26)14-24-8-6-23(7-9-24)13-18-12-21-20(25(18)10-11-29-3)30(27,28)15-17-4-5-17/h12,16-17H,4-11,13-15H2,1-3H3,(H,22,26)/p+1