N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrazole-4-carboxamide

Systemtic Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrazole-4-carboxamide Openeye Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrazole-4-carboxamide CAS Name: N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-1H-pyrazole-4-carboxamide IUPAC Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrazole-4-carboxamide Traditional Name: N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrazole-4-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CNN=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CNN=C4

InChI

InChI=1S/C22H22N6O/c29-22(17-13-25-26-14-17)24-15-20-27-19-11-5-4-10-18(19)21(28-20)23-12-6-9-16-7-2-1-3-8-16/h1-5,7-8,10-11,13-14H,6,9,12,15H2,(H,24,29)(H,25,26)(H,23,27,28)