5-[(2-fluoranyl-4-methoxy-phenyl)methyl]-5-[3-oxidanylidene-3-(4-quinazolin-4-ylpiperazin-1-yl)propyl]pyrrolidin-2-one

Systemtic Name: 5-[(2-fluoranyl-4-methoxy-phenyl)methyl]-5-[3-oxidanylidene-3-(4-quinazolin-4-ylpiperazin-1-yl)propyl]pyrrolidin-2-one Openeye Name: 5-[(2-fluoro-4-methoxy-phenyl)methyl]-5-[3-oxo-3-(4-quinazolin-4-ylpiperazin-1-yl)propyl]pyrrolidin-2-one CAS Name: 5-[(2-fluoro-4-methoxyphenyl)methyl]-5-[3-oxo-3-[4-(4-quinazolinyl)-1-piperazinyl]propyl]-2-pyrrolidinone IUPAC Name: 5-[(2-fluoro-4-methoxyphenyl)methyl]-5-[3-oxo-3-(4-quinazolin-4-ylpiperazin-1-yl)propyl]pyrrolidin-2-one Traditional Name: 5-(2-fluoro-4-methoxy-benzyl)-5-[3-keto-3-(4-quinazolin-4-ylpiperazino)propyl]-2-pyrrolidone Formula: C27H30FN5O3 MolecularWeight: 491.557203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC2(CCC(=O)N2)CCC(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54)F

Isomeric SMILES

COC1=CC(=C(C=C1)CC2(CCC(=O)N2)CCC(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54)F

InChI

InChI=1S/C27H30FN5O3/c1-36-20-7-6-19(22(28)16-20)17-27(10-8-24(34)31-27)11-9-25(35)32-12-14-33(15-13-32)26-21-4-2-3-5-23(21)29-18-30-26/h2-7,16,18H,8-15,17H2,1H3,(H,31,34)