1-[1-methyl-2-(2-piperidin-1-ium-1-ylethyl)benzimidazol-5-yl]-3-phenyl-urea

Systemtic Name: 1-[1-methyl-2-(2-piperidin-1-ium-1-ylethyl)benzimidazol-5-yl]-3-phenyl-urea Openeye Name: 1-[1-methyl-2-(2-piperidin-1-ium-1-ylethyl)benzimidazol-5-yl]-3-phenyl-urea CAS Name: 1-[1-methyl-2-[2-(1-piperidin-1-iumyl)ethyl]-5-benzimidazolyl]-3-phenylurea IUPAC Name: 1-[1-methyl-2-(2-piperidin-1-ium-1-ylethyl)benzimidazol-5-yl]-3-phenylurea Traditional Name: 1-[1-methyl-2-(2-piperidin-1-ium-1-ylethyl)benzimidazol-5-yl]-3-phenyl-urea Formula: C22H28N5O+ MolecularWeight: 378.49062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)N=C1CC[NH+]4CCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)N=C1CC[NH+]4CCCCC4

InChI

InChI=1S/C22H27N5O/c1-26-20-11-10-18(24-22(28)23-17-8-4-2-5-9-17)16-19(20)25-21(26)12-15-27-13-6-3-7-14-27/h2,4-5,8-11,16H,3,6-7,12-15H2,1H3,(H2,23,24,28)/p+1