2-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]propanamide

Systemtic Name: 2-[4-[(3-ethynylphenyl)amino]-7-methoxy-quinazolin-6-yl]propanamide Openeye Name: 2-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]propanamide CAS Name: 2-[4-(3-ethynylanilino)-7-methoxy-6-quinazolinyl]propanamide IUPAC Name: 2-[4-(3-ethynylanilino)-7-methoxyquinazolin-6-yl]propanamide Traditional Name: 2-[4-(3-ethynylanilino)-7-methoxy-quinazolin-6-yl]propionamide Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OC)C(=O)N

Isomeric SMILES

CC(C1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OC)C(=O)N

InChI

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