(E)-4-bromanyl-N-[4-[(3-bromophenyl)amino]-7-methoxy-quinazolin-6-yl]but-2-enamide

Systemtic Name: (E)-4-bromanyl-N-[4-[(3-bromophenyl)amino]-7-methoxy-quinazolin-6-yl]but-2-enamide Openeye Name: (E)-4-bromo-N-[4-(3-bromoanilino)-7-methoxy-quinazolin-6-yl]but-2-enamide CAS Name: (E)-4-bromo-N-[4-(3-bromoanilino)-7-methoxy-6-quinazolinyl]-2-butenamide IUPAC Name: (E)-4-bromo-N-[4-(3-bromoanilino)-7-methoxyquinazolin-6-yl]but-2-enamide Traditional Name: (E)-4-bromo-N-[4-(3-bromoanilino)-7-methoxy-quinazolin-6-yl]but-2-enamide Formula: C19H16Br2N4O2 MolecularWeight: 492.16394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)NC(=O)C=CCBr

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)NC(=O)/C=C/CBr

InChI

InChI=1S/C19H16Br2N4O2/c1-27-17-10-15-14(9-16(17)25-18(26)6-3-7-20)19(23-11-22-15)24-13-5-2-4-12(21)8-13/h2-6,8-11H,7H2,1H3,(H,25,26)(H,22,23,24)/b6-3+