(E)-N-[4-[(3-bromophenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-4-morpholin-4-yl-but-2-enamide

Systemtic Name: (E)-N-[4-[(3-bromophenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-4-morpholin-4-yl-but-2-enamide Openeye Name: (E)-N-[4-(3-bromoanilino)-3-cyano-7-ethoxy-6-quinolyl]-4-morpholino-but-2-enamide CAS Name: (E)-N-[4-(3-bromoanilino)-3-cyano-7-ethoxy-6-quinolinyl]-4-(4-morpholinyl)-2-butenamide IUPAC Name: (E)-N-[4-(3-bromoanilino)-3-cyano-7-ethoxyquinolin-6-yl]-4-morpholin-4-ylbut-2-enamide Traditional Name: (E)-N-[4-(3-bromoanilino)-3-cyano-7-ethoxy-6-quinolyl]-4-morpholino-but-2-enamide Formula: C26H26BrN5O3 MolecularWeight: 536.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=CC=C3)Br)C#N)NC(=O)C=CCN4CCOCC4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=CC=C3)Br)C#N)NC(=O)/C=C/CN4CCOCC4

InChI

InChI=1S/C26H26BrN5O3/c1-2-35-24-15-22-21(14-23(24)31-25(33)7-4-8-32-9-11-34-12-10-32)26(18(16-28)17-29-22)30-20-6-3-5-19(27)13-20/h3-7,13-15,17H,2,8-12H2,1H3,(H,29,30)(H,31,33)/b7-4+