2-azanyl-6-[[(4-fluorophenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-azanyl-6-[[(4-fluorophenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-amino-6-[(4-fluoro-N-prop-2-ynyl-anilino)methyl]-1H-quinazolin-4-one CAS Name: 2-amino-6-[(4-fluoro-N-prop-2-ynylanilino)methyl]-1H-quinazolin-4-one IUPAC Name: 2-amino-6-[(4-fluoro-N-prop-2-ynylanilino)methyl]-1H-quinazolin-4-one Traditional Name: 2-amino-6-[(4-fluoro-N-propargyl-anilino)methyl]-1H-quinazolin-4-one Formula: C18H15FN4O MolecularWeight: 322.336303

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=CC2=C(C=C1)NC(=NC2=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

C#CCN(CC1=CC2=C(C=C1)NC(=NC2=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN4O/c1-2-9-23(14-6-4-13(19)5-7-14)11-12-3-8-16-15(10-12)17(24)22-18(20)21-16/h1,3-8,10H,9,11H2,(H3,20,21,22,24)