4-butyl-N-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-pentyl-benzamide

Systemtic Name: 4-butyl-N-[1-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-pentyl-benzamide Openeye Name: 4-butyl-N-[1-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]propyl]-N-pentyl-benzamide CAS Name: 4-butyl-N-[1-[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]propyl]-N-pentylbenzamide IUPAC Name: 4-butyl-N-[1-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]propyl]-N-pentylbenzamide Traditional Name: N-amyl-4-butyl-N-[1-[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]propyl]benzamide Formula: C33H38FN3O2 MolecularWeight: 527.672123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)CCCC

Isomeric SMILES

CCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)CCCC

InChI

InChI=1S/C33H38FN3O2/c1-4-7-11-23-36(32(38)25-17-15-24(16-18-25)12-8-5-2)30(6-3)31-35-29-14-10-9-13-28(29)33(39)37(31)27-21-19-26(34)20-22-27/h9-10,13-22,30H,4-8,11-12,23H2,1-3H3