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

Systemtic Name: N-[(2S)-2-[(4-ethylpiperazin-1-ium-1-yl)methyl]-1-propan-2-yl-2,3-dihydrobenzimidazol-5-yl]benzamide Openeye Name: N-[(2S)-2-[(4-ethylpiperazin-1-ium-1-yl)methyl]-1-isopropyl-2,3-dihydrobenzimidazol-5-yl]benzamide CAS Name: N-[(2S)-2-[(4-ethyl-1-piperazin-1-iumyl)methyl]-1-propan-2-yl-2,3-dihydrobenzimidazol-5-yl]benzamide IUPAC Name: N-[(2S)-2-[(4-ethylpiperazin-1-ium-1-yl)methyl]-1-propan-2-yl-2,3-dihydrobenzimidazol-5-yl]benzamide Traditional Name: N-[(2S)-2-[(4-ethylpiperazin-1-ium-1-yl)methyl]-1-isopropyl-2,3-dihydrobenzimidazol-5-yl]benzamide Formula: C24H34N5O+ MolecularWeight: 408.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[NH+](CC1)CC2NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1CC[NH+](CC1)C[C@H]2NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H33N5O/c1-4-27-12-14-28(15-13-27)17-23-26-21-16-20(10-11-22(21)29(23)18(2)3)25-24(30)19-8-6-5-7-9-19/h5-11,16,18,23,26H,4,12-15,17H2,1-3H3,(H,25,30)/p+1/t23-/m0/s1