N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloro-5-methylsulfonyl-phenyl)acetamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(2-chloro-5-mesyl-phenyl)acetamide Formula: C15H17ClN4O3S2 MolecularWeight: 400.90348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C15H17ClN4O3S2/c1-4-7-20-10(2)18-19-15(20)24-9-14(21)17-13-8-11(25(3,22)23)5-6-12(13)16/h4-6,8H,1,7,9H2,2-3H3,(H,17,21)