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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCCC1=NC2=CC=CC=C2C(=O)N1N

Isomeric SMILES

CC#CCCC1=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/h5-8H,4,9,14H2,1H3