2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(2,4-dimethoxyphenyl)carbamate

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(2,4-dimethoxyphenyl)carbamate Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-(2,4-dimethoxyphenyl)carbamate CAS Name: N-(2,4-dimethoxyphenyl)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-(2,4-dimethoxyphenyl)carbamate Traditional Name: N-(2,4-dimethoxyphenyl)carbamic acid 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl ester Formula: C26H27N3O4S2 MolecularWeight: 509.64028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCOC(=O)NC2=C(C=C(C=C2)OC)OC)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCCOC(=O)NC2=C(C=C(C=C2)OC)OC)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H27N3O4S2/c1-17-18(16-35-25-27-20-8-4-5-9-21(20)28-25)7-6-10-24(17)34-14-13-33-26(30)29-22-12-11-19(31-2)15-23(22)32-3/h4-12,15H,13-14,16H2,1-3H3,(H,27,28)(H,29,30)