N,N-diethyl-2-[(4-methylsulfanylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazole-5-sulfonamide

Systemtic Name: N,N-diethyl-2-[(4-methylsulfanylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazole-5-sulfonamide Openeye Name: N,N-diethyl-1-isopropyl-2-[(4-methylsulfanylphenyl)methylsulfanyl]benzimidazole-5-sulfonamide CAS Name: N,N-diethyl-2-[[4-(methylthio)phenyl]methylthio]-1-propan-2-yl-5-benzimidazolesulfonamide IUPAC Name: N,N-diethyl-2-[(4-methylsulfanylphenyl)methylsulfanyl]-1-propan-2-ylbenzimidazole-5-sulfonamide Traditional Name: N,N-diethyl-1-isopropyl-2-[[4-(methylthio)benzyl]thio]benzimidazole-5-sulfonamide Formula: C22H29N3O2S3 MolecularWeight: 463.67956

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=C(C=C3)SC)C(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=C(C=C3)SC)C(C)C

InChI

InChI=1S/C22H29N3O2S3/c1-6-24(7-2)30(26,27)19-12-13-21-20(14-19)23-22(25(21)16(3)4)29-15-17-8-10-18(28-5)11-9-17/h8-14,16H,6-7,15H2,1-5H3