1-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-3-phenyl-urea

Systemtic Name: 1-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-3-phenyl-urea Openeye Name: 1-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-3-phenyl-urea CAS Name: 1-[1-methyl-2-(1-pyrrolidin-1-iumylmethyl)-5-benzimidazolyl]-3-phenylurea IUPAC Name: 1-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-3-phenylurea Traditional Name: 1-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]-3-phenyl-urea Formula: C20H24N5O+ MolecularWeight: 350.43746

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)N=C1C[NH+]4CCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)N=C1C[NH+]4CCCC4

InChI

InChI=1S/C20H23N5O/c1-24-18-10-9-16(22-20(26)21-15-7-3-2-4-8-15)13-17(18)23-19(24)14-25-11-5-6-12-25/h2-4,7-10,13H,5-6,11-12,14H2,1H3,(H2,21,22,26)/p+1