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

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(2-methylphenyl)carbamate Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(o-tolyl)carbamate CAS Name: N-(2-methylphenyl)carbamic 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-(2-methylphenyl)carbamate Traditional Name: N-(o-tolyl)carbamic acid 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl ester Formula: C25H25N3O2S2 MolecularWeight: 463.6149

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)OCCSC2=CC=CC(=C2C)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)OCCSC2=CC=CC(=C2C)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C25H25N3O2S2/c1-17-8-3-4-10-20(17)28-25(29)30-14-15-31-23-13-7-9-19(18(23)2)16-32-24-26-21-11-5-6-12-22(21)27-24/h3-13H,14-16H2,1-2H3,(H,26,27)(H,28,29)