5-bromanyl-3-[2-(3,4-dimethylphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]indol-2-one

Systemtic Name: 5-bromanyl-3-[2-(3,4-dimethylphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]indol-2-one Openeye Name: 5-bromo-3-[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]indol-2-one CAS Name: 5-bromo-3-[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-2-indolone IUPAC Name: 5-bromo-3-[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]indol-2-one Traditional Name: 5-bromo-3-[1-(3,4-dimethylphenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]indol-2-one Formula: C20H16BrN3O2 MolecularWeight: 410.26394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)C3=C4C=C(C=CC4=NC3=O)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)C3=C4C=C(C=CC4=NC3=O)Br)C

InChI

InChI=1S/C20H16BrN3O2/c1-10-4-6-14(8-11(10)2)24-20(26)17(12(3)23-24)18-15-9-13(21)5-7-16(15)22-19(18)25/h4-9,23H,1-3H3