1-[2-[(3-bromophenyl)amino]-7-ethanoyl-4-(1H-indazol-5-ylamino)quinazolin-6-yl]ethanone

Systemtic Name: 1-[2-[(3-bromophenyl)amino]-7-ethanoyl-4-(1H-indazol-5-ylamino)quinazolin-6-yl]ethanone Openeye Name: 1-[7-acetyl-2-(3-bromoanilino)-4-(1H-indazol-5-ylamino)quinazolin-6-yl]ethanone CAS Name: 1-[7-acetyl-2-(3-bromoanilino)-4-(1H-indazol-5-ylamino)-6-quinazolinyl]ethanone IUPAC Name: 1-[7-acetyl-2-(3-bromoanilino)-4-(1H-indazol-5-ylamino)quinazolin-6-yl]ethanone Traditional Name: 1-[7-acetyl-2-(3-bromoanilino)-4-(1H-indazol-5-ylamino)quinazolin-6-yl]ethanone Formula: C25H19BrN6O2 MolecularWeight: 515.36136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC(=CC=C3)Br)NC4=CC5=C(C=C4)NN=C5)C(=O)C

Isomeric SMILES

CC(=O)C1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC(=CC=C3)Br)NC4=CC5=C(C=C4)NN=C5)C(=O)C

InChI

InChI=1S/C25H19BrN6O2/c1-13(33)19-10-21-23(11-20(19)14(2)34)30-25(29-17-5-3-4-16(26)9-17)31-24(21)28-18-6-7-22-15(8-18)12-27-32-22/h3-12H,1-2H3,(H,27,32)(H2,28,29,30,31)