N-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-N-methyl-2-[(2R)-1-(2-methylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-N-methyl-2-[(2R)-1-(2-methylpropyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-2-[(2R)-1-isobutyl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-acetamide CAS Name: N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-N-methyl-2-[(2R)-1-(2-methylpropyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-N-methyl-2-[(2R)-1-(2-methylpropyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-2-[(2R)-1-isobutyl-3-keto-piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C19H27ClN5O2+ MolecularWeight: 392.90298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCNC(=O)C1CC(=O)N(C)CC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)C[NH+]1CCNC(=O)[C@H]1CC(=O)N(C)CC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C19H26ClN5O2/c1-12(2)10-25-7-6-21-19(27)16(25)9-18(26)24(3)11-17-22-14-5-4-13(20)8-15(14)23-17/h4-5,8,12,16H,6-7,9-11H2,1-3H3,(H,21,27)(H,22,23)/p+1/t16-/m1/s1