3-azanyl-4-[2,6-bis(chloranyl)phenyl]-2-tert-butyl-1H-pyrazol-5-one

Systemtic Name: 3-azanyl-4-[2,6-bis(chloranyl)phenyl]-2-tert-butyl-1H-pyrazol-5-one Openeye Name: 3-amino-2-tert-butyl-4-(2,6-dichlorophenyl)-1H-pyrazol-5-one CAS Name: 3-amino-2-tert-butyl-4-(2,6-dichlorophenyl)-1H-pyrazol-5-one IUPAC Name: 3-amino-2-tert-butyl-4-(2,6-dichlorophenyl)-1H-pyrazol-5-one Traditional Name: 5-amino-1-tert-butyl-4-(2,6-dichlorophenyl)-3-pyrazolin-3-one Formula: C13H15Cl2N3O MolecularWeight: 300.1837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C(C(=O)N1)C2=C(C=CC=C2Cl)Cl)N

Isomeric SMILES

CC(C)(C)N1C(=C(C(=O)N1)C2=C(C=CC=C2Cl)Cl)N

InChI

InChI=1S/C13H15Cl2N3O/c1-13(2,3)18-11(16)10(12(19)17-18)9-7(14)5-4-6-8(9)15/h4-6H,16H2,1-3H3,(H,17,19)