ethyl 3-(1H-benzimidazol-2-ylmethylsulfanyl)-3-phenyl-propanoate

Systemtic Name: ethyl 3-(1H-benzimidazol-2-ylmethylsulfanyl)-3-phenyl-propanoate Openeye Name: ethyl 3-(1H-benzimidazol-2-ylmethylsulfanyl)-3-phenyl-propanoate CAS Name: 3-(1H-benzimidazol-2-ylmethylthio)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-(1H-benzimidazol-2-ylmethylsulfanyl)-3-phenylpropanoate Traditional Name: 3-(1H-benzimidazol-2-ylmethylthio)-3-phenyl-propionic acid ethyl ester Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)SCC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)CC(C1=CC=CC=C1)SCC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H20N2O2S/c1-2-23-19(22)12-17(14-8-4-3-5-9-14)24-13-18-20-15-10-6-7-11-16(15)21-18/h3-11,17H,2,12-13H2,1H3,(H,20,21)