N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)quinazolin-4-yl]-phenethyl-amino]propanamide

Systemtic Name: N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)quinazolin-4-yl]-phenethyl-amino]propanamide Openeye Name: N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)quinazolin-4-yl]-phenethyl-amino]propanamide CAS Name: N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)-4-quinazolinyl]-phenethylamino]propanamide IUPAC Name: N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)quinazolin-4-yl]-phenethylamino]propanamide Traditional Name: N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)quinazolin-4-yl]-phenethyl-amino]propionamide Formula: C32H29FN4O2 MolecularWeight: 520.596663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N(CCC4=CC=CC=C4)CCC(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)N(CCC4=CC=CC=C4)CCC(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C32H29FN4O2/c1-39-27-16-14-24(15-17-27)31-35-29-13-6-5-12-28(29)32(36-31)37(20-18-23-8-3-2-4-9-23)21-19-30(38)34-26-11-7-10-25(33)22-26/h2-17,22H,18-21H2,1H3,(H,34,38)