6-[4-(2-methoxyethoxy)but-1-ynyl]-N-(3-methyl-4-pyridin-3-yloxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-[4-(2-methoxyethoxy)but-1-ynyl]-N-(3-methyl-4-pyridin-3-yloxy-phenyl)quinazolin-4-amine Openeye Name: 6-[4-(2-methoxyethoxy)but-1-ynyl]-N-[3-methyl-4-(3-pyridyloxy)phenyl]quinazolin-4-amine CAS Name: 6-[4-(2-methoxyethoxy)but-1-ynyl]-N-[3-methyl-4-(3-pyridinyloxy)phenyl]-4-quinazolinamine IUPAC Name: 6-[4-(2-methoxyethoxy)but-1-ynyl]-N-(3-methyl-4-pyridin-3-yloxyphenyl)quinazolin-4-amine Traditional Name: [6-[4-(2-methoxyethoxy)but-1-ynyl]quinazolin-4-yl]-[3-methyl-4-(3-pyridyloxy)phenyl]amine Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCCOCCOC)OC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCCOCCOC)OC4=CN=CC=C4

InChI

InChI=1S/C27H26N4O3/c1-20-16-22(9-11-26(20)34-23-7-5-12-28-18-23)31-27-24-17-21(8-10-25(24)29-19-30-27)6-3-4-13-33-15-14-32-2/h5,7-12,16-19H,4,13-15H2,1-2H3,(H,29,30,31)