N-(3-chloranyl-4-cyano-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C12H10ClN5OS MolecularWeight: 307.7587

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CN1C=NN=C1SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C12H10ClN5OS/c1-18-7-15-17-12(18)20-6-11(19)16-9-3-2-8(5-14)10(13)4-9/h2-4,7H,6H2,1H3,(H,16,19)