N-(5-chloranyl-2-methoxy-phenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[[4-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[4-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[4-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H14ClN5O2S MolecularWeight: 375.83266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=CN2C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=CN2C3=CN=CC=C3

InChI

InChI=1S/C16H14ClN5O2S/c1-24-14-5-4-11(17)7-13(14)20-15(23)9-25-16-21-19-10-22(16)12-3-2-6-18-8-12/h2-8,10H,9H2,1H3,(H,20,23)