N-(2-methylpropyl)-3-[(2-phenylquinazolin-4-yl)amino]-1H-pyrazole-5-carboxamide

Systemtic Name: N-(2-methylpropyl)-3-[(2-phenylquinazolin-4-yl)amino]-1H-pyrazole-5-carboxamide Openeye Name: N-isobutyl-3-[(2-phenylquinazolin-4-yl)amino]-1H-pyrazole-5-carboxamide CAS Name: N-(2-methylpropyl)-3-[(2-phenyl-4-quinazolinyl)amino]-1H-pyrazole-5-carboxamide IUPAC Name: N-(2-methylpropyl)-3-[(2-phenylquinazolin-4-yl)amino]-1H-pyrazole-5-carboxamide Traditional Name: N-isobutyl-3-[(2-phenylquinazolin-4-yl)amino]-1H-pyrazole-5-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6O/c1-14(2)13-23-22(29)18-12-19(28-27-18)25-21-16-10-6-7-11-17(16)24-20(26-21)15-8-4-3-5-9-15/h3-12,14H,13H2,1-2H3,(H,23,29)(H2,24,25,26,27,28)