3-azanyl-2-nona-2,7-diyn-5-yl-quinazolin-4-one

Systemtic Name: 3-azanyl-2-nona-2,7-diyn-5-yl-quinazolin-4-one Openeye Name: 3-amino-2-(1-but-2-ynylpent-3-ynyl)quinazolin-4-one CAS Name: 3-amino-2-nona-2,7-diyn-5-yl-4-quinazolinone IUPAC Name: 3-amino-2-nona-2,7-diyn-5-ylquinazolin-4-one Traditional Name: 3-amino-2-(1-but-2-ynylpent-3-ynyl)quinazolin-4-one Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(CC#CC)C1=NC2=CC=CC=C2C(=O)N1N

Isomeric SMILES

CC#CCC(CC#CC)C1=NC2=CC=CC=C2C(=O)N1N

InChI

InChI=1S/C17H17N3O/c1-3-5-9-13(10-6-4-2)16-19-15-12-8-7-11-14(15)17(21)20(16)18/h7-8,11-13H,9-10,18H2,1-2H3