3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxidanylpyridin-2-yl)propanamide

Systemtic Name: 3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(3-oxidanylpyridin-2-yl)propanamide Openeye Name: N-(3-hydroxy-2-pyridyl)-3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(3-hydroxy-2-pyridinyl)-3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(3-hydroxypyridin-2-yl)-3-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(3-hydroxy-2-pyridyl)-3-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=C(C=CC=N3)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NC3=C(C=CC=N3)O

InChI

InChI=1S/C17H17N5O3S/c1-25-12-6-4-11(5-7-12)16-20-21-17(26)22(16)10-8-14(24)19-15-13(23)3-2-9-18-15/h2-7,9,23H,8,10H2,1H3,(H,21,26)(H,18,19,24)