2-[[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]methylamino]ethanamide

Systemtic Name: 2-[[4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]methylamino]ethanamide Openeye Name: 2-[[4-(3-chloro-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl]methylamino]acetamide CAS Name: 2-[[4-(3-chloro-2-fluoroanilino)-7-methoxy-6-quinazolinyl]methylamino]acetamide IUPAC Name: 2-[[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]methylamino]acetamide Traditional Name: 2-[[4-(3-chloro-2-fluoro-anilino)-7-methoxy-quinazolin-6-yl]methylamino]acetamide Formula: C18H17ClFN5O2 MolecularWeight: 389.811283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)CNCC(=O)N

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=C(C(=CC=C3)Cl)F)CNCC(=O)N

InChI

InChI=1S/C18H17ClFN5O2/c1-27-15-6-14-11(5-10(15)7-22-8-16(21)26)18(24-9-23-14)25-13-4-2-3-12(19)17(13)20/h2-6,9,22H,7-8H2,1H3,(H2,21,26)(H,23,24,25)