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

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-[(1R)-1-phenylethyl]carbamate Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl N-[(1R)-1-phenylethyl]carbamate CAS Name: N-[(1R)-1-phenylethyl]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-[(1R)-1-phenylethyl]carbamate Traditional Name: N-[(1R)-1-phenylethyl]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=C(C=CC=C1SCCOC(=O)NC(C)C2=CC=CC=C2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCCOC(=O)N[C@H](C)C2=CC=CC=C2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H27N3O2S2/c1-18-21(17-33-25-28-22-12-6-7-13-23(22)29-25)11-8-14-24(18)32-16-15-31-26(30)27-19(2)20-9-4-3-5-10-20/h3-14,19H,15-17H2,1-2H3,(H,27,30)(H,28,29)/t19-/m1/s1