4-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]morpholine

Systemtic Name: 4-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]morpholine Openeye Name: 4-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-phenyl]sulfanylethyl]morpholine CAS Name: 4-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methylphenyl]thio]ethyl]morpholine IUPAC Name: 4-[2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylphenyl]sulfanylethyl]morpholine Traditional Name: 4-[2-[[3-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-phenyl]thio]ethyl]morpholine Formula: C21H25N3OS2 MolecularWeight: 399.5727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCN2CCOCC2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC=C1SCCN2CCOCC2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H25N3OS2/c1-16-17(15-27-21-22-18-6-2-3-7-19(18)23-21)5-4-8-20(16)26-14-11-24-9-12-25-13-10-24/h2-8H,9-15H2,1H3,(H,22,23)