3-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]propanamide

Systemtic Name: 3-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]propanamide Openeye Name: 3-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]propanamide CAS Name: 3-[4-(3-ethynylanilino)-7-methoxy-6-quinazolinyl]propanamide IUPAC Name: 3-[4-(3-ethynylanilino)-7-methoxyquinazolin-6-yl]propanamide Traditional Name: 3-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]propionamide Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)CCC(=O)N

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC=CC(=C3)C#C)CCC(=O)N

InChI

InChI=1S/C20H18N4O2/c1-3-13-5-4-6-15(9-13)24-20-16-10-14(7-8-19(21)25)18(26-2)11-17(16)22-12-23-20/h1,4-6,9-12H,7-8H2,2H3,(H2,21,25)(H,22,23,24)