butyl 2-chloranyl-5-[[3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]benzoate

Systemtic Name: butyl 2-chloranyl-5-[[3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]benzoate Openeye Name: butyl 2-chloro-5-[[3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]benzoate CAS Name: 2-chloro-5-[[3-(3,5-dimethyl-1-pyrazolyl)-2-quinoxalinyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-chloro-5-[[3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]benzoate Traditional Name: 2-chloro-5-[[3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]benzoic acid butyl ester Formula: C24H24ClN5O2 MolecularWeight: 449.93266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CC(=C1)NC2=NC3=CC=CC=C3N=C2N4C(=CC(=N4)C)C)Cl

Isomeric SMILES

CCCCOC(=O)C1=C(C=CC(=C1)NC2=NC3=CC=CC=C3N=C2N4C(=CC(=N4)C)C)Cl

InChI

InChI=1S/C24H24ClN5O2/c1-4-5-12-32-24(31)18-14-17(10-11-19(18)25)26-22-23(30-16(3)13-15(2)29-30)28-21-9-7-6-8-20(21)27-22/h6-11,13-14H,4-5,12H2,1-3H3,(H,26,27)