N,N,1-triethyl-2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzimidazole-5-sulfonamide

Systemtic Name: N,N,1-triethyl-2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzimidazole-5-sulfonamide Openeye Name: N,N,1-triethyl-2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzimidazole-5-sulfonamide CAS Name: N,N,1-triethyl-2-(2-imidazo[1,2-a]pyridinylmethylthio)-5-benzimidazolesulfonamide IUPAC Name: N,N,1-triethyl-2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)benzimidazole-5-sulfonamide Traditional Name: N,N,1-triethyl-2-(imidazo[1,2-a]pyridin-2-ylmethylthio)benzimidazole-5-sulfonamide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CN4C=CC=CC4=N3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C21H25N5O2S2/c1-4-25(5-2)30(27,28)17-10-11-19-18(13-17)23-21(26(19)6-3)29-15-16-14-24-12-8-7-9-20(24)22-16/h7-14H,4-6,15H2,1-3H3