N-[4-[(3-bromophenyl)amino]-7-(4-methylpiperazin-1-yl)quinazolin-6-yl]prop-2-enamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]-7-(4-methylpiperazin-1-yl)quinazolin-6-yl]prop-2-enamide Openeye Name: N-[4-(3-bromoanilino)-7-(4-methylpiperazin-1-yl)quinazolin-6-yl]prop-2-enamide CAS Name: N-[4-(3-bromoanilino)-7-(4-methyl-1-piperazinyl)-6-quinazolinyl]-2-propenamide IUPAC Name: N-[4-(3-bromoanilino)-7-(4-methylpiperazin-1-yl)quinazolin-6-yl]prop-2-enamide Traditional Name: N-[4-(3-bromoanilino)-7-(4-methylpiperazino)quinazolin-6-yl]acrylamide Formula: C22H23BrN6O MolecularWeight: 467.36162

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)NC(=O)C=C

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)NC(=O)C=C

InChI

InChI=1S/C22H23BrN6O/c1-3-21(30)27-19-12-17-18(13-20(19)29-9-7-28(2)8-10-29)24-14-25-22(17)26-16-6-4-5-15(23)11-16/h3-6,11-14H,1,7-10H2,2H3,(H,27,30)(H,24,25,26)