2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethanamide

Systemtic Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-1-piperazin-1-iumyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-ium-1-yl]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)acetamide Formula: C21H26N5O2+ MolecularWeight: 380.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC(=O)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC(=O)NC3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C21H25N5O2/c1-14-3-4-15(2)19(11-14)26-9-7-25(8-10-26)13-20(27)22-16-5-6-17-18(12-16)24-21(28)23-17/h3-6,11-12H,7-10,13H2,1-2H3,(H,22,27)(H2,23,24,28)/p+1