N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)but-2-ynamide

Systemtic Name: N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)but-2-ynamide Openeye Name: N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)but-2-ynamide CAS Name: N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)-2-butynamide IUPAC Name: N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)but-2-ynamide Traditional Name: N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)but-2-ynamide Formula: C18H17N3O MolecularWeight: 291.34708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)NC1CCCC2=NC(=NC=C12)C3=CC=CC=C3

Isomeric SMILES

CC#CC(=O)NC1CCCC2=NC(=NC=C12)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O/c1-2-7-17(22)20-15-10-6-11-16-14(15)12-19-18(21-16)13-8-4-3-5-9-13/h3-5,8-9,12,15H,6,10-11H2,1H3,(H,20,22)