azanium N-butylsulfonyl-2-ethyl-3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]benzimidazole-5-carboxamide

Systemtic Name: azanium N-butylsulfonyl-2-ethyl-3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]benzimidazole-5-carboxamide Openeye Name: ammonium N-butylsulfonyl-2-ethyl-3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]benzimidazole-5-carboxamide CAS Name: ammonium N-butylsulfonyl-2-ethyl-3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-5-benzimidazolecarboxamide IUPAC Name: azanium N-butylsulfonyl-2-ethyl-3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]benzimidazole-5-carboxamide Traditional Name: ammonium N-butylsulfonyl-2-ethyl-3-[4-(4-fluorobenzyl)oxybenzyl]benzimidazole-5-carboxamide Formula: C28H34FN4O4S+ MolecularWeight: 541.657363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)OCC4=CC=C(C=C4)F)CC.[NH4+]

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)OCC4=CC=C(C=C4)F)CC.[NH4+]

InChI

InChI=1S/C28H30FN3O4S.H3N/c1-3-5-16-37(34,35)31-28(33)22-10-15-25-26(17-22)32(27(4-2)30-25)18-20-8-13-24(14-9-20)36-19-21-6-11-23(29)12-7-21;/h6-15,17H,3-5,16,18-19H2,1-2H3,(H,31,33);1H3/p+1