6-ethynyl-N-(2-methoxyethyl)-2-pyridin-4-yl-quinazolin-4-amine

Systemtic Name: 6-ethynyl-N-(2-methoxyethyl)-2-pyridin-4-yl-quinazolin-4-amine Openeye Name: 6-ethynyl-N-(2-methoxyethyl)-2-(4-pyridyl)quinazolin-4-amine CAS Name: 6-ethynyl-N-(2-methoxyethyl)-2-pyridin-4-yl-4-quinazolinamine IUPAC Name: 6-ethynyl-N-(2-methoxyethyl)-2-pyridin-4-ylquinazolin-4-amine Traditional Name: [6-ethynyl-2-(4-pyridyl)quinazolin-4-yl]-(2-methoxyethyl)amine Formula: C18H16N4O MolecularWeight: 304.34584

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=C1C=C(C=C2)C#C)C3=CC=NC=C3

Isomeric SMILES

COCCNC1=NC(=NC2=C1C=C(C=C2)C#C)C3=CC=NC=C3

InChI

InChI=1S/C18H16N4O/c1-3-13-4-5-16-15(12-13)18(20-10-11-23-2)22-17(21-16)14-6-8-19-9-7-14/h1,4-9,12H,10-11H2,2H3,(H,20,21,22)