1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenyl-urea

Systemtic Name: 1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenyl-urea Openeye Name: 1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenyl-urea CAS Name: 1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenylurea IUPAC Name: 1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenylurea Traditional Name: 1-(2-cyclohexyl-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium-8-yl)-3-phenyl-urea Formula: C23H28N5O+ MolecularWeight: 390.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)NC5=CC=CC=C5)C2

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN3C(=NC4=C3C=CC(=C4)NC(=O)NC5=CC=CC=C5)C2

InChI

InChI=1S/C23H27N5O/c29-23(24-17-7-3-1-4-8-17)25-18-11-12-21-20(15-18)26-22-16-27(13-14-28(21)22)19-9-5-2-6-10-19/h1,3-4,7-8,11-12,15,19H,2,5-6,9-10,13-14,16H2,(H2,24,25,29)/p+1