1-(2-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione

Systemtic Name: 1-(2-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione Openeye Name: 1-(2-chloro-4-methylsulfonyl-phenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione CAS Name: 1-(2-chloro-4-methylsulfonylphenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione IUPAC Name: 1-(2-chloro-4-methylsulfonylphenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione Traditional Name: 1-(2-chloro-4-mesyl-phenyl)-3-cyclopropyl-2-(1H-1,2,4-triazol-5-yl)propane-1,3-dione Formula: C15H14ClN3O4S MolecularWeight: 367.80736

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NC=NN2)C(=O)C3CC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NC=NN2)C(=O)C3CC3)Cl

InChI

InChI=1S/C15H14ClN3O4S/c1-24(22,23)9-4-5-10(11(16)6-9)14(21)12(13(20)8-2-3-8)15-17-7-18-19-15/h4-8,12H,2-3H2,1H3,(H,17,18,19)