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

Systemtic Name: (E)-N-[2-[(3-bromophenyl)amino]quinazolin-6-yl]but-2-enamide Openeye Name: (E)-N-[2-(3-bromoanilino)quinazolin-6-yl]but-2-enamide CAS Name: (E)-N-[2-(3-bromoanilino)-6-quinazolinyl]-2-butenamide IUPAC Name: (E)-N-[2-(3-bromoanilino)quinazolin-6-yl]but-2-enamide Traditional Name: (E)-N-[2-(3-bromoanilino)quinazolin-6-yl]but-2-enamide Formula: C18H15BrN4O MolecularWeight: 383.2419

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=CC2=CN=C(N=C2C=C1)NC3=CC(=CC=C3)Br

Isomeric SMILES

C/C=C/C(=O)NC1=CC2=CN=C(N=C2C=C1)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H15BrN4O/c1-2-4-17(24)21-15-7-8-16-12(9-15)11-20-18(23-16)22-14-6-3-5-13(19)10-14/h2-11H,1H3,(H,21,24)(H,20,22,23)/b4-2+