N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-3-methyl-benzamide

Systemtic Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]-3-methyl-benzamide Openeye Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-3-methyl-benzamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-propan-2-yl-5-benzimidazolyl]-3-methylbenzamide IUPAC Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]-3-methylbenzamide Traditional Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]-3-methyl-benzamide Formula: C25H34N5O+ MolecularWeight: 420.57036

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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)C4=CC(=CC=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H33N5O/c1-5-28-11-13-29(14-12-28)17-24-27-22-16-21(9-10-23(22)30(24)18(2)3)26-25(31)20-8-6-7-19(4)15-20/h6-10,15-16,18H,5,11-14,17H2,1-4H3,(H,26,31)/p+1