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

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C12H13ClN4O2S MolecularWeight: 312.77522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)NC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C12H13ClN4O2S/c1-7-15-16-12(17(7)2)20-6-11(19)14-9-5-8(13)3-4-10(9)18/h3-5,18H,6H2,1-2H3,(H,14,19)