2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[cyclopropyl(2-furylmethyl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[cyclopropyl(2-furanylmethyl)amino]methyl]-N,N-dimethyl-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,N-dimethyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[cyclopropyl(2-furfuryl)amino]methyl]-N,N-dimethyl-1-propyl-benzimidazole-5-sulfonamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN(CC3=CC=CO3)C4CC4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN(CC3=CC=CO3)C4CC4

InChI

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