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

Systemtic Name: (E)-4-bromanyl-N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]but-2-enamide Openeye Name: (E)-4-bromo-N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]but-2-enamide CAS Name: (E)-4-bromo-N-[4-(3-bromoanilino)-3-cyano-6-quinolinyl]-2-butenamide IUPAC Name: (E)-4-bromo-N-[4-(3-bromoanilino)-3-cyanoquinolin-6-yl]but-2-enamide Traditional Name: (E)-4-bromo-N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]but-2-enamide Formula: C20H14Br2N4O MolecularWeight: 486.15936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)NC(=O)C=CCBr

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=C3C=C(C=CC3=NC=C2C#N)NC(=O)/C=C/CBr

InChI

InChI=1S/C20H14Br2N4O/c21-8-2-5-19(27)25-16-6-7-18-17(10-16)20(13(11-23)12-24-18)26-15-4-1-3-14(22)9-15/h1-7,9-10,12H,8H2,(H,24,26)(H,25,27)/b5-2+