N,N-dimethyl-2-[[6-(4-methylphenyl)sulfonyl-1H-benzimidazol-2-yl]sulfanylmethyl]aniline

Systemtic Name: N,N-dimethyl-2-[[6-(4-methylphenyl)sulfonyl-1H-benzimidazol-2-yl]sulfanylmethyl]aniline Openeye Name: N,N-dimethyl-2-[[6-(p-tolylsulfonyl)-1H-benzimidazol-2-yl]sulfanylmethyl]aniline CAS Name: N,N-dimethyl-2-[[[6-(4-methylphenyl)sulfonyl-1H-benzimidazol-2-yl]thio]methyl]aniline IUPAC Name: N,N-dimethyl-2-[[6-(4-methylphenyl)sulfonyl-1H-benzimidazol-2-yl]sulfanylmethyl]aniline Traditional Name: dimethyl-[2-[[(6-tosyl-1H-benzimidazol-2-yl)thio]methyl]phenyl]amine Formula: C23H23N3O2S2 MolecularWeight: 437.57762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)SCC4=CC=CC=C4N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC3=C(C=C2)N=C(N3)SCC4=CC=CC=C4N(C)C

InChI

InChI=1S/C23H23N3O2S2/c1-16-8-10-18(11-9-16)30(27,28)19-12-13-20-21(14-19)25-23(24-20)29-15-17-6-4-5-7-22(17)26(2)3/h4-14H,15H2,1-3H3,(H,24,25)