6-(3-azanylprop-1-ynyl)-N-(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-(3-azanylprop-1-ynyl)-N-(4,5-dimethyl-2-pyridin-3-yloxy-phenyl)quinazolin-4-amine Openeye Name: 6-(3-aminoprop-1-ynyl)-N-[4,5-dimethyl-2-(3-pyridyloxy)phenyl]quinazolin-4-amine CAS Name: 6-(3-aminoprop-1-ynyl)-N-[4,5-dimethyl-2-(3-pyridinyloxy)phenyl]-4-quinazolinamine IUPAC Name: 6-(3-aminoprop-1-ynyl)-N-(4,5-dimethyl-2-pyridin-3-yloxyphenyl)quinazolin-4-amine Traditional Name: [6-(3-aminoprop-1-ynyl)quinazolin-4-yl]-[4,5-dimethyl-2-(3-pyridyloxy)phenyl]amine Formula: C24H21N5O MolecularWeight: 395.45644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)OC2=CN=CC=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCN

Isomeric SMILES

CC1=CC(=C(C=C1C)OC2=CN=CC=C2)NC3=NC=NC4=C3C=C(C=C4)C#CCN

InChI

InChI=1S/C24H21N5O/c1-16-11-22(23(12-17(16)2)30-19-6-4-10-26-14-19)29-24-20-13-18(5-3-9-25)7-8-21(20)27-15-28-24/h4,6-8,10-15H,9,25H2,1-2H3,(H,27,28,29)