3-[(4-fluorophenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methyl-quinazoline-2,4-dione

Systemtic Name: 3-[(4-fluorophenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methyl-quinazoline-2,4-dione Openeye Name: 3-[(4-fluorophenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methyl-quinazoline-2,4-dione CAS Name: 3-[(4-fluorophenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methylquinazoline-2,4-dione IUPAC Name: 3-[(4-fluorophenyl)methyl]-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methylquinazoline-2,4-dione Traditional Name: 3-(4-fluorobenzyl)-6-[3-(4-methoxyphenyl)prop-1-ynyl]-1-methyl-quinazoline-2,4-quinone Formula: C26H21FN2O3 MolecularWeight: 428.454943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C#CCC3=CC=C(C=C3)OC)C(=O)N(C1=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)C#CCC3=CC=C(C=C3)OC)C(=O)N(C1=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C26H21FN2O3/c1-28-24-15-10-19(5-3-4-18-8-13-22(32-2)14-9-18)16-23(24)25(30)29(26(28)31)17-20-6-11-21(27)12-7-20/h6-16H,4,17H2,1-2H3