(E)-4-[4-[(3-bromophenyl)amino]quinazolin-6-yl]but-3-en-2-one

Systemtic Name: (E)-4-[4-[(3-bromophenyl)amino]quinazolin-6-yl]but-3-en-2-one Openeye Name: (E)-4-[4-(3-bromoanilino)quinazolin-6-yl]but-3-en-2-one CAS Name: (E)-4-[4-(3-bromoanilino)-6-quinazolinyl]-3-buten-2-one IUPAC Name: (E)-4-[4-(3-bromoanilino)quinazolin-6-yl]but-3-en-2-one Traditional Name: (E)-4-[4-(3-bromoanilino)quinazolin-6-yl]but-3-en-2-one Formula: C18H14BrN3O MolecularWeight: 368.22726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(=O)/C=C/C1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H14BrN3O/c1-12(23)5-6-13-7-8-17-16(9-13)18(21-11-20-17)22-15-4-2-3-14(19)10-15/h2-11H,1H3,(H,20,21,22)/b6-5+