2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanyl-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanyl-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]-N-(tetrahydrofurfuryl)acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCC(=O)NCC2CCCO2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCC(=O)NCC2CCCO2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H25N3O2S2/c1-15-16(13-29-22-24-18-8-2-3-9-19(18)25-22)6-4-10-20(15)28-14-21(26)23-12-17-7-5-11-27-17/h2-4,6,8-10,17H,5,7,11-14H2,1H3,(H,23,26)(H,24,25)