ethyl 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]thio]acetic acid ethyl ester Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=CC=N1)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)CSC1=C(C=CC=N1)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H15N3O2S/c1-2-21-14(20)10-22-16-11(6-5-9-17-16)15-18-12-7-3-4-8-13(12)19-15/h3-9H,2,10H2,1H3,(H,18,19)