3-azanyl-2-pent-4-ynyl-quinazolin-4-one

Systemtic Name: 3-azanyl-2-pent-4-ynyl-quinazolin-4-one Openeye Name: 3-amino-2-pent-4-ynyl-quinazolin-4-one CAS Name: 3-amino-2-pent-4-ynyl-4-quinazolinone IUPAC Name: 3-amino-2-pent-4-ynylquinazolin-4-one Traditional Name: 3-amino-2-pent-4-ynyl-quinazolin-4-one Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCC1=NC2=CC=CC=C2C(=O)N1N

Isomeric SMILES

C#CCCCC1=NC2=CC=CC=C2C(=O)N1N

InChI

InChI=1S/C13H13N3O/c1-2-3-4-9-12-15-11-8-6-5-7-10(11)13(17)16(12)14/h1,5-8H,3-4,9,14H2