4-chloranyl-5-[(2-chloranyl-5-methyl-phenyl)amino]-2-(4-methylsulfonylphenyl)-4H-pyrazol-3-one

Systemtic Name: 4-chloranyl-5-[(2-chloranyl-5-methyl-phenyl)amino]-2-(4-methylsulfonylphenyl)-4H-pyrazol-3-one Openeye Name: 4-chloro-5-(2-chloro-5-methyl-anilino)-2-(4-methylsulfonylphenyl)-4H-pyrazol-3-one CAS Name: 4-chloro-5-(2-chloro-5-methylanilino)-2-(4-methylsulfonylphenyl)-4H-pyrazol-3-one IUPAC Name: 4-chloro-5-(2-chloro-5-methylanilino)-2-(4-methylsulfonylphenyl)-4H-pyrazol-3-one Traditional Name: 4-chloro-5-(2-chloro-5-methyl-anilino)-2-(4-mesylphenyl)-2-pyrazolin-3-one Formula: C17H15Cl2N3O3S MolecularWeight: 412.2903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC2=NN(C(=O)C2Cl)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC2=NN(C(=O)C2Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H15Cl2N3O3S/c1-10-3-8-13(18)14(9-10)20-16-15(19)17(23)22(21-16)11-4-6-12(7-5-11)26(2,24)25/h3-9,15H,1-2H3,(H,20,21)