N,N-diethyl-2-[(4-ethylphenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(4-ethylphenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-2-[(4-ethylphenyl)methylsulfanyl]-1-(2-furylmethyl)benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-2-[(4-ethylphenyl)methylthio]-1-(2-furanylmethyl)-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-2-[(4-ethylphenyl)methylsulfanyl]-1-(furan-2-ylmethyl)benzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-2-[(4-ethylbenzyl)thio]-1-(2-furfuryl)benzimidazole-5-sulfonamide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CO4)C=CC(=C3)S(=O)(=O)N(CC)CC

Isomeric SMILES

CCC1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CO4)C=CC(=C3)S(=O)(=O)N(CC)CC

InChI

InChI=1S/C25H29N3O3S2/c1-4-19-9-11-20(12-10-19)18-32-25-26-23-16-22(33(29,30)27(5-2)6-3)13-14-24(23)28(25)17-21-8-7-15-31-21/h7-16H,4-6,17-18H2,1-3H3