6,7-diethoxy-N-(5-ethynyl-2-methyl-phenyl)quinazolin-4-amine

Systemtic Name: 6,7-diethoxy-N-(5-ethynyl-2-methyl-phenyl)quinazolin-4-amine Openeye Name: 6,7-diethoxy-N-(5-ethynyl-2-methyl-phenyl)quinazolin-4-amine CAS Name: 6,7-diethoxy-N-(5-ethynyl-2-methylphenyl)-4-quinazolinamine IUPAC Name: 6,7-diethoxy-N-(5-ethynyl-2-methylphenyl)quinazolin-4-amine Traditional Name: (6,7-diethoxyquinazolin-4-yl)-(5-ethynyl-2-methyl-phenyl)amine Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C#C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C#C)C)OCC

InChI

InChI=1S/C21H21N3O2/c1-5-15-9-8-14(4)17(10-15)24-21-16-11-19(25-6-2)20(26-7-3)12-18(16)22-13-23-21/h1,8-13H,6-7H2,2-4H3,(H,22,23,24)