N-(4-methoxyphenyl)-2-[(5-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-[(5-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[[5-(3-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-methoxyphenyl)-2-[[5-(3-pyridinyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-[(5-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-methoxyphenyl)-2-[[5-(3-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C16H15N5O2S/c1-23-13-6-4-12(5-7-13)18-14(22)10-24-16-19-15(20-21-16)11-3-2-8-17-9-11/h2-9H,10H2,1H3,(H,18,22)(H,19,20,21)