5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 5-tert-butyl-4-(2,4-dichlorophenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C21H19Cl2N3O MolecularWeight: 400.30106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)(C)N1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H19Cl2N3O/c1-21(2,3)26-19(14-10-9-13(22)11-15(14)23)16-17(12-7-5-4-6-8-12)24-25-18(16)20(26)27/h4-11,19H,1-3H3,(H,24,25)