5-chloranyl-N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-(2-cyclohexyl-4-oxidanylidene-quinazolin-3-yl)-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-(2-cyclohexyl-4-oxo-quinazolin-3-yl)-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-(2-cyclohexyl-4-oxo-3-quinazolinyl)-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-(2-cyclohexyl-4-oxoquinazolin-3-yl)-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-(2-cyclohexyl-4-keto-quinazolin-3-yl)-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C25H24ClN5O2 MolecularWeight: 461.94336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4CCCCC4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NN2C(=NC3=CC=CC=C3C2=O)C4CCCCC4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H24ClN5O2/c1-16-21(22(26)30(28-16)18-12-6-3-7-13-18)24(32)29-31-23(17-10-4-2-5-11-17)27-20-15-9-8-14-19(20)25(31)33/h3,6-9,12-15,17H,2,4-5,10-11H2,1H3,(H,29,32)