1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[methyl(2-phenoxyethyl)amino]methyl]benzimidazole-5-sulfonamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CCOC3=CC=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(C)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3S/c1-3-4-12-25-20-11-10-18(29(22,26)27)15-19(20)23-21(25)16-24(2)13-14-28-17-8-6-5-7-9-17/h5-11,15H,3-4,12-14,16H2,1-2H3,(H2,22,26,27)