2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-cyclohexylcarbamate

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-cyclohexylcarbamate Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-cyclohexylcarbamate CAS Name: N-cyclohexylcarbamic acid 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]ethyl ester IUPAC Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanylethyl N-cyclohexylcarbamate Traditional Name: N-cyclohexylcarbamic acid 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl ester Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCOC(=O)NC2CCCCC2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCCOC(=O)NC2CCCCC2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H29N3O2S2/c1-17-18(16-31-23-26-20-11-5-6-12-21(20)27-23)8-7-13-22(17)30-15-14-29-24(28)25-19-9-3-2-4-10-19/h5-8,11-13,19H,2-4,9-10,14-16H2,1H3,(H,25,28)(H,26,27)