N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H19ClN4O3S2 MolecularWeight: 414.93006

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl)C3CC3

InChI

InChI=1S/C16H19ClN4O3S2/c1-3-21-15(10-4-5-10)19-20-16(21)25-9-14(22)18-13-8-11(26(2,23)24)6-7-12(13)17/h6-8,10H,3-5,9H2,1-2H3,(H,18,22)