N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-4-(3-chloranyl-2-cyano-phenoxy)benzenesulfonamide

Systemtic Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-4-(3-chloranyl-2-cyano-phenoxy)benzenesulfonamide Openeye Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]-4-(3-chloro-2-cyano-phenoxy)benzenesulfonamide CAS Name: N-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]ethyl]-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide IUPAC Name: N-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanylethyl]-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide Traditional Name: N-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl]-4-(3-chloro-2-cyano-phenoxy)benzenesulfonamide Formula: C30H25ClN4O3S3 MolecularWeight: 621.1925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCNS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C(C=CC=C1SCCNS(=O)(=O)C2=CC=C(C=C2)OC3=C(C(=CC=C3)Cl)C#N)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C30H25ClN4O3S3/c1-20-21(19-40-30-34-26-8-2-3-9-27(26)35-30)6-4-11-29(20)39-17-16-33-41(36,37)23-14-12-22(13-15-23)38-28-10-5-7-25(31)24(28)18-32/h2-15,33H,16-17,19H2,1H3,(H,34,35)