4-(4-ethylpiperazin-4-ium-1-yl)-1-[(3-fluorophenyl)methyl]-3,5-dimethyl-N-(2-methylpropyl)pyrrole-2-carboxamide

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-[(3-fluorophenyl)methyl]-3,5-dimethyl-N-(2-methylpropyl)pyrrole-2-carboxamide Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-[(3-fluorophenyl)methyl]-N-isobutyl-3,5-dimethyl-pyrrole-2-carboxamide CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-1-[(3-fluorophenyl)methyl]-3,5-dimethyl-N-(2-methylpropyl)-2-pyrrolecarboxamide IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-[(3-fluorophenyl)methyl]-3,5-dimethyl-N-(2-methylpropyl)pyrrole-2-carboxamide Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-1-(3-fluorobenzyl)-N-isobutyl-3,5-dimethyl-pyrrole-2-carboxamide Formula: C24H36FN4O+ MolecularWeight: 415.567243

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(N(C(=C2C)C(=O)NCC(C)C)CC3=CC(=CC=C3)F)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(N(C(=C2C)C(=O)NCC(C)C)CC3=CC(=CC=C3)F)C

InChI

InChI=1S/C24H35FN4O/c1-6-27-10-12-28(13-11-27)22-18(4)23(24(30)26-15-17(2)3)29(19(22)5)16-20-8-7-9-21(25)14-20/h7-9,14,17H,6,10-13,15-16H2,1-5H3,(H,26,30)/p+1