2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-cyclohexyl-ethanamide dihydrochloride

Systemtic Name: 2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-cyclohexyl-ethanamide dihydrochloride Openeye Name: 2-[5-carbamimidoyl-2-[[4-[(1-ethanimidoyl-4-piperidyl)oxy]phenoxy]methyl]benzimidazol-1-yl]-N-cyclohexyl-acetamide dihydrochloride CAS Name: 2-[5-carbamimidoyl-2-[[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]phenoxy]methyl]-1-benzimidazolyl]-N-cyclohexylacetamide dihydrochloride IUPAC Name: 2-[5-carbamimidoyl-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenoxy]methyl]benzimidazol-1-yl]-N-cyclohexylacetamide dihydrochloride Traditional Name: 2-[2-[[4-[(1-acetimidoyl-4-piperidyl)oxy]phenoxy]methyl]-5-amidino-benzimidazol-1-yl]-N-cyclohexyl-acetamide dihydrochloride Formula: C30H41Cl2N7O3 MolecularWeight: 618.59764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)OCC3=NC4=C(N3CC(=O)NC5CCCCC5)C=CC(=C4)C(=N)N.Cl.Cl

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)OCC3=NC4=C(N3CC(=O)NC5CCCCC5)C=CC(=C4)C(=N)N.Cl.Cl

InChI

InChI=1S/C30H39N7O3.2ClH/c1-20(31)36-15-13-25(14-16-36)40-24-10-8-23(9-11-24)39-19-28-35-26-17-21(30(32)33)7-12-27(26)37(28)18-29(38)34-22-5-3-2-4-6-22;;/h7-12,17,22,25,31H,2-6,13-16,18-19H2,1H3,(H3,32,33)(H,34,38);2*1H