N,N-dimethyl-2-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[allyl(2-thienylmethyl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: N,N-dimethyl-2-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: N,N-dimethyl-2-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[allyl(2-thenyl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Formula: C21H28N4O2S2 MolecularWeight: 432.60262

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN(CC=C)CC3=CC=CS3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN(CC=C)CC3=CC=CS3

InChI

InChI=1S/C21H28N4O2S2/c1-5-11-24(15-17-8-7-13-28-17)16-21-22-19-14-18(29(26,27)23(3)4)9-10-20(19)25(21)12-6-2/h5,7-10,13-14H,1,6,11-12,15-16H2,2-4H3