6-[[(6-ethanoylpyridin-3-yl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 6-[[(6-ethanoylpyridin-3-yl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 6-[[(6-acetyl-3-pyridyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 6-[[(6-acetyl-3-pyridinyl)-prop-2-ynylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 6-[[(6-acetylpyridin-3-yl)-prop-2-ynylamino]methyl]-1H-quinazolin-4-one Traditional Name: 6-[[(6-acetyl-3-pyridyl)-propargyl-amino]methyl]-1H-quinazolin-4-one Formula: C19H16N4O2 MolecularWeight: 332.35594

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC=C(C=C1)N(CC#C)CC2=CC3=C(C=C2)NC=NC3=O

Isomeric SMILES

CC(=O)C1=NC=C(C=C1)N(CC#C)CC2=CC3=C(C=C2)NC=NC3=O

InChI

InChI=1S/C19H16N4O2/c1-3-8-23(15-5-7-17(13(2)24)20-10-15)11-14-4-6-18-16(9-14)19(25)22-12-21-18/h1,4-7,9-10,12H,8,11H2,2H3,(H,21,22,25)