N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-7-morpholin-4-yl-hept-2-ynamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]quinazolin-6-yl]-7-morpholin-4-yl-hept-2-ynamide Openeye Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-7-morpholino-hept-2-ynamide CAS Name: N-[4-(3-bromoanilino)-6-quinazolinyl]-7-(4-morpholinyl)-2-heptynamide IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-7-morpholin-4-ylhept-2-ynamide Traditional Name: N-[4-(3-bromoanilino)quinazolin-6-yl]-7-morpholino-hept-2-ynamide Formula: C25H26BrN5O2 MolecularWeight: 508.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1CCCCC#CC(=O)NC2=CC3=C(C=C2)N=CN=C3NC4=CC(=CC=C4)Br

InChI

InChI=1S/C25H26BrN5O2/c26-19-6-5-7-20(16-19)30-25-22-17-21(9-10-23(22)27-18-28-25)29-24(32)8-3-1-2-4-11-31-12-14-33-15-13-31/h5-7,9-10,16-18H,1-2,4,11-15H2,(H,29,32)(H,27,28,30)