ethyl (2S)-2-(1H-benzimidazol-2-ylsulfanyl)-3-(4-methoxyphenyl)propanoate

Systemtic Name: ethyl (2S)-2-(1H-benzimidazol-2-ylsulfanyl)-3-(4-methoxyphenyl)propanoate Openeye Name: ethyl (2S)-2-(1H-benzimidazol-2-ylsulfanyl)-3-(4-methoxyphenyl)propanoate CAS Name: (2S)-2-(1H-benzimidazol-2-ylthio)-3-(4-methoxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(1H-benzimidazol-2-ylsulfanyl)-3-(4-methoxyphenyl)propanoate Traditional Name: (2S)-2-(1H-benzimidazol-2-ylthio)-3-(4-methoxyphenyl)propionic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=C(C=C1)OC)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H20N2O3S/c1-3-24-18(22)17(12-13-8-10-14(23-2)11-9-13)25-19-20-15-6-4-5-7-16(15)21-19/h4-11,17H,3,12H2,1-2H3,(H,20,21)/t17-/m0/s1