1-[2-[2-(4-ethylpiperazin-4-ium-1-yl)ethyl]-1-methyl-benzimidazol-5-yl]-3-phenyl-urea

Systemtic Name: 1-[2-[2-(4-ethylpiperazin-4-ium-1-yl)ethyl]-1-methyl-benzimidazol-5-yl]-3-phenyl-urea Openeye Name: 1-[2-[2-(4-ethylpiperazin-4-ium-1-yl)ethyl]-1-methyl-benzimidazol-5-yl]-3-phenyl-urea CAS Name: 1-[2-[2-(4-ethyl-1-piperazin-4-iumyl)ethyl]-1-methyl-5-benzimidazolyl]-3-phenylurea IUPAC Name: 1-[2-[2-(4-ethylpiperazin-4-ium-1-yl)ethyl]-1-methylbenzimidazol-5-yl]-3-phenylurea Traditional Name: 1-[2-[2-(4-ethylpiperazin-4-ium-1-yl)ethyl]-1-methyl-benzimidazol-5-yl]-3-phenyl-urea Formula: C23H31N6O+ MolecularWeight: 407.53184

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCC2=NC3=C(N2C)C=CC(=C3)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)CCC2=NC3=C(N2C)C=CC(=C3)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H30N6O/c1-3-28-13-15-29(16-14-28)12-11-22-26-20-17-19(9-10-21(20)27(22)2)25-23(30)24-18-7-5-4-6-8-18/h4-10,17H,3,11-16H2,1-2H3,(H2,24,25,30)/p+1