2-[4-[(3-ethynylphenyl)amino]-7-propoxy-quinazolin-6-yl]ethanamide

Systemtic Name: 2-[4-[(3-ethynylphenyl)amino]-7-propoxy-quinazolin-6-yl]ethanamide Openeye Name: 2-[4-(3-ethynylanilino)-7-propoxy-quinazolin-6-yl]acetamide CAS Name: 2-[4-(3-ethynylanilino)-7-propoxy-6-quinazolinyl]acetamide IUPAC Name: 2-[4-(3-ethynylanilino)-7-propoxyquinazolin-6-yl]acetamide Traditional Name: 2-[4-(3-ethynylanilino)-7-propoxy-quinazolin-6-yl]acetamide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)CC(=O)N

Isomeric SMILES

CCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)CC(=O)N

InChI

InChI=1S/C21H20N4O2/c1-3-8-27-19-12-18-17(10-15(19)11-20(22)26)21(24-13-23-18)25-16-7-5-6-14(4-2)9-16/h2,5-7,9-10,12-13H,3,8,11H2,1H3,(H2,22,26)(H,23,24,25)