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

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-[(3-methylphenyl)methyl]carbamate Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(m-tolylmethyl)carbamate CAS Name: N-[(3-methylphenyl)methyl]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-[(3-methylphenyl)methyl]carbamate Traditional Name: N-(3-methylbenzyl)carbamic acid 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl ester Formula: C26H27N3O2S2 MolecularWeight: 477.64148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)OCCSC2=CC=CC(=C2C)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)OCCSC2=CC=CC(=C2C)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H27N3O2S2/c1-18-7-5-8-20(15-18)16-27-26(30)31-13-14-32-24-12-6-9-21(19(24)2)17-33-25-28-22-10-3-4-11-23(22)29-25/h3-12,15H,13-14,16-17H2,1-2H3,(H,27,30)(H,28,29)