3-[4-(5-methyl-2-propan-2-yl-phenoxy)but-2-ynyl]quinazolin-4-one

Systemtic Name: 3-[4-(5-methyl-2-propan-2-yl-phenoxy)but-2-ynyl]quinazolin-4-one Openeye Name: 3-[4-(2-isopropyl-5-methyl-phenoxy)but-2-ynyl]quinazolin-4-one CAS Name: 3-[4-(5-methyl-2-propan-2-ylphenoxy)but-2-ynyl]-4-quinazolinone IUPAC Name: 3-[4-(5-methyl-2-propan-2-ylphenoxy)but-2-ynyl]quinazolin-4-one Traditional Name: 3-[4-(2-isopropyl-5-methyl-phenoxy)but-2-ynyl]quinazolin-4-one Formula: C22H22N2O2 MolecularWeight: 346.42228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC#CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC#CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H22N2O2/c1-16(2)18-11-10-17(3)14-21(18)26-13-7-6-12-24-15-23-20-9-5-4-8-19(20)22(24)25/h4-5,8-11,14-16H,12-13H2,1-3H3