6-[[(5-chloranylpyridin-2-yl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 6-[[(5-chloranylpyridin-2-yl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 6-[[(5-chloro-2-pyridyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 6-[[(5-chloro-2-pyridinyl)-prop-2-ynylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 6-[[(5-chloropyridin-2-yl)-prop-2-ynylamino]methyl]-1H-quinazolin-4-one Traditional Name: 6-[[(5-chloro-2-pyridyl)-propargyl-amino]methyl]-1H-quinazolin-4-one Formula: C17H13ClN4O MolecularWeight: 324.76432

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC1=CC2=C(C=C1)NC=NC2=O)C3=NC=C(C=C3)Cl

Isomeric SMILES

C#CCN(CC1=CC2=C(C=C1)NC=NC2=O)C3=NC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN4O/c1-2-7-22(16-6-4-13(18)9-19-16)10-12-3-5-15-14(8-12)17(23)21-11-20-15/h1,3-6,8-9,11H,7,10H2,(H,20,21,23)