2-[but-3-ynyl(methyl)amino]pyrimido[2,1-a]isoquinolin-4-one

Systemtic Name: 2-[but-3-ynyl(methyl)amino]pyrimido[2,1-a]isoquinolin-4-one Openeye Name: 2-[but-3-ynyl(methyl)amino]pyrimido[2,1-a]isoquinolin-4-one CAS Name: 2-[but-3-ynyl(methyl)amino]-4-pyrimido[2,1-a]isoquinolinone IUPAC Name: 2-[but-3-ynyl(methyl)amino]pyrimido[2,1-a]isoquinolin-4-one Traditional Name: 2-[but-3-ynyl(methyl)amino]pyrimid[2,1-a]isoquinolin-4-one Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#C)C1=CC(=O)N2C=CC3=CC=CC=C3C2=N1

Isomeric SMILES

CN(CCC#C)C1=CC(=O)N2C=CC3=CC=CC=C3C2=N1

InChI

InChI=1S/C17H15N3O/c1-3-4-10-19(2)15-12-16(21)20-11-9-13-7-5-6-8-14(13)17(20)18-15/h1,5-9,11-12H,4,10H2,2H3