2-(2-chloranylphenoxy)-N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(2-chloranylphenoxy)-N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]ethanamide Openeye Name: 2-(2-chlorophenoxy)-N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]acetamide CAS Name: 2-(2-chlorophenoxy)-N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-propan-2-yl-5-benzimidazolyl]acetamide IUPAC Name: 2-(2-chlorophenoxy)-N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]acetamide Traditional Name: 2-(2-chlorophenoxy)-N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]acetamide Formula: C25H33ClN5O2+ MolecularWeight: 471.01482

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=CC=C4Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)COC4=CC=CC=C4Cl

InChI

InChI=1S/C25H32ClN5O2/c1-4-29-11-13-30(14-12-29)16-24-28-21-15-19(9-10-22(21)31(24)18(2)3)27-25(32)17-33-23-8-6-5-7-20(23)26/h5-10,15,18H,4,11-14,16-17H2,1-3H3,(H,27,32)/p+1