3-[[2-(4-fluorophenyl)quinazolin-4-yl]-(phenylmethyl)amino]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[[2-(4-fluorophenyl)quinazolin-4-yl]-(phenylmethyl)amino]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[benzyl-[2-(4-fluorophenyl)quinazolin-4-yl]amino]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[[2-(4-fluorophenyl)-4-quinazolinyl]-(phenylmethyl)amino]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[benzyl-[2-(4-fluorophenyl)quinazolin-4-yl]amino]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[benzyl-[2-(4-fluorophenyl)quinazolin-4-yl]amino]-1-pyrrolidino-propan-1-one Formula: C28H27FN4O MolecularWeight: 454.538583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCN(CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)C(=O)CCN(CC2=CC=CC=C2)C3=NC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H27FN4O/c29-23-14-12-22(13-15-23)27-30-25-11-5-4-10-24(25)28(31-27)33(20-21-8-2-1-3-9-21)19-16-26(34)32-17-6-7-18-32/h1-5,8-15H,6-7,16-20H2