4-chloranyl-2,5-dimethyl-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-2,5-dimethyl-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]pyrazole-3-carboxamide Openeye Name: 4-chloro-2,5-dimethyl-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]pyrazole-3-carboxamide CAS Name: 4-chloro-2,5-dimethyl-N-[1-[2-(4-morpholin-4-iumyl)ethyl]-2-benzimidazolyl]-3-pyrazolecarboxamide IUPAC Name: 4-chloro-2,5-dimethyl-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]pyrazole-3-carboxamide Traditional Name: 4-chloro-2,5-dimethyl-N-[1-(2-morpholin-4-ium-4-ylethyl)benzimidazol-2-yl]pyrazole-3-carboxamide Formula: C19H24ClN6O2+ MolecularWeight: 403.88586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=NN(C(=C1Cl)C(=O)NC2=NC3=CC=CC=C3N2CC[NH+]4CCOCC4)C

InChI

InChI=1S/C19H23ClN6O2/c1-13-16(20)17(24(2)23-13)18(27)22-19-21-14-5-3-4-6-15(14)26(19)8-7-25-9-11-28-12-10-25/h3-6H,7-12H2,1-2H3,(H,21,22,27)/p+1