ethyl 4-[(2-methylsulfanylbenzimidazol-1-yl)methyl]benzoate

Systemtic Name: ethyl 4-[(2-methylsulfanylbenzimidazol-1-yl)methyl]benzoate Openeye Name: ethyl 4-[(2-methylsulfanylbenzimidazol-1-yl)methyl]benzoate CAS Name: 4-[[2-(methylthio)-1-benzimidazolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methylsulfanylbenzimidazol-1-yl)methyl]benzoate Traditional Name: 4-[[2-(methylthio)benzimidazol-1-yl]methyl]benzoic acid ethyl ester Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SC

InChI

InChI=1S/C18H18N2O2S/c1-3-22-17(21)14-10-8-13(9-11-14)12-20-16-7-5-4-6-15(16)19-18(20)23-2/h4-11H,3,12H2,1-2H3