N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-5-(dimethylamino)pent-2-ynamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-5-(dimethylamino)pent-2-ynamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-5-(dimethylamino)pent-2-ynamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-5-(dimethylamino)-2-pentynamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-5-(dimethylamino)pent-2-ynamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-5-(dimethylamino)pent-2-ynamide Formula: C21H20BrN5O MolecularWeight: 438.3204

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC#CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

Isomeric SMILES

CN(C)CCC#CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H20BrN5O/c1-27(2)11-4-3-8-20(28)25-17-9-10-19-18(13-17)21(24-14-23-19)26-16-7-5-6-15(22)12-16/h5-7,9-10,12-14H,4,11H2,1-2H3,(H,25,28)(H,23,24,26)