N-[1-[6-bromanyl-4-[(4-chloranyl-2-fluoranyl-phenyl)amino]quinazolin-2-yl]piperidin-4-yl]-N-cyclohexyl-1-methyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[6-bromanyl-4-[(4-chloranyl-2-fluoranyl-phenyl)amino]quinazolin-2-yl]piperidin-4-yl]-N-cyclohexyl-1-methyl-pyrrolidine-2-carboxamide Openeye Name: N-[1-[6-bromo-4-(4-chloro-2-fluoro-anilino)quinazolin-2-yl]-4-piperidyl]-N-cyclohexyl-1-methyl-pyrrolidine-2-carboxamide CAS Name: N-[1-[6-bromo-4-(4-chloro-2-fluoroanilino)-2-quinazolinyl]-4-piperidinyl]-N-cyclohexyl-1-methyl-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[6-bromo-4-(4-chloro-2-fluoroanilino)quinazolin-2-yl]piperidin-4-yl]-N-cyclohexyl-1-methylpyrrolidine-2-carboxamide Traditional Name: N-[1-[6-bromo-4-(4-chloro-2-fluoro-anilino)quinazolin-2-yl]-4-piperidyl]-N-cyclohexyl-1-methyl-pyrrolidine-2-carboxamide Formula: C31H37BrClFN6O MolecularWeight: 644.020483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1C(=O)N(C2CCCCC2)C3CCN(CC3)C4=NC5=C(C=C(C=C5)Br)C(=N4)NC6=C(C=C(C=C6)Cl)F

Isomeric SMILES

CN1CCCC1C(=O)N(C2CCCCC2)C3CCN(CC3)C4=NC5=C(C=C(C=C5)Br)C(=N4)NC6=C(C=C(C=C6)Cl)F

InChI

InChI=1S/C31H37BrClFN6O/c1-38-15-5-8-28(38)30(41)40(22-6-3-2-4-7-22)23-13-16-39(17-14-23)31-36-26-11-9-20(32)18-24(26)29(37-31)35-27-12-10-21(33)19-25(27)34/h9-12,18-19,22-23,28H,2-8,13-17H2,1H3,(H,35,36,37)