N-(3-ethynylphenyl)-7-methoxy-6-pyridin-2-yl-quinazolin-4-amine

Systemtic Name: N-(3-ethynylphenyl)-7-methoxy-6-pyridin-2-yl-quinazolin-4-amine Openeye Name: N-(3-ethynylphenyl)-7-methoxy-6-(2-pyridyl)quinazolin-4-amine CAS Name: N-(3-ethynylphenyl)-7-methoxy-6-(2-pyridinyl)-4-quinazolinamine IUPAC Name: N-(3-ethynylphenyl)-7-methoxy-6-pyridin-2-ylquinazolin-4-amine Traditional Name: (3-ethynylphenyl)-[7-methoxy-6-(2-pyridyl)quinazolin-4-yl]amine Formula: C22H16N4O MolecularWeight: 352.38864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)C4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)C4=CC=CC=N4

InChI

InChI=1S/C22H16N4O/c1-3-15-7-6-8-16(11-15)26-22-18-12-17(19-9-4-5-10-23-19)21(27-2)13-20(18)24-14-25-22/h1,4-14H,2H3,(H,24,25,26)