2-[5-azanyl-3-[(4-fluorophenyl)methyl]-1-methyl-pyrazol-4-yl]-1H-quinazolin-4-one

Systemtic Name: 2-[5-azanyl-3-[(4-fluorophenyl)methyl]-1-methyl-pyrazol-4-yl]-1H-quinazolin-4-one Openeye Name: 2-[5-amino-3-[(4-fluorophenyl)methyl]-1-methyl-pyrazol-4-yl]-1H-quinazolin-4-one CAS Name: 2-[5-amino-3-[(4-fluorophenyl)methyl]-1-methyl-4-pyrazolyl]-1H-quinazolin-4-one IUPAC Name: 2-[5-amino-3-[(4-fluorophenyl)methyl]-1-methylpyrazol-4-yl]-1H-quinazolin-4-one Traditional Name: 2-[5-amino-3-(4-fluorobenzyl)-1-methyl-pyrazol-4-yl]-1H-quinazolin-4-one Formula: C19H16FN5O MolecularWeight: 349.361643

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)CC2=CC=C(C=C2)F)C3=NC(=O)C4=CC=CC=C4N3)N

Isomeric SMILES

CN1C(=C(C(=N1)CC2=CC=C(C=C2)F)C3=NC(=O)C4=CC=CC=C4N3)N

InChI

InChI=1S/C19H16FN5O/c1-25-17(21)16(15(24-25)10-11-6-8-12(20)9-7-11)18-22-14-5-3-2-4-13(14)19(26)23-18/h2-9H,10,21H2,1H3,(H,22,23,26)