[4-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[(6-bromo-4-phenyl-2-quinazolinyl)amino]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[(6-bromo-4-phenylquinazolin-2-yl)amino]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]phenyl]-pyrrolidino-methanone Formula: C25H21BrN4O MolecularWeight: 473.36444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)NC3=NC4=C(C=C(C=C4)Br)C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C25H21BrN4O/c26-19-10-13-22-21(16-19)23(17-6-2-1-3-7-17)29-25(28-22)27-20-11-8-18(9-12-20)24(31)30-14-4-5-15-30/h1-3,6-13,16H,4-5,14-15H2,(H,27,28,29)