Molecular Formula: C25H17ClN4O3;

Molecular Weight: 456.886;

Exact Mass: 456.0989;

Synonym: NAV-2729; NAV 2729; NAV2729.;

Related CAS#: 419547-11-8;

Chemical Name: 3-(4-Chlorophenyl)-5-(4-nitrophenyl)-2-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7(4H)-one;

InChi Key: GUUWHOSUKOCRHG-UHFFFAOYSA-N;

InChi Code: InChI=1S/C25H17ClN4O3/c26-19-10-6-18(7-11-19)24-22(14-16-4-2-1-3-5-16)28-29-23(31)15-21(27-25(24)29)17-8-12-20(13-9-17)30(32)33/h1-13,15,27H,14H2;

SMILES: O=C1C=C(C2=CC=C([N+]([O-])=O)C=C2)NC3=C(C4=CC=C(Cl)C=C4)C(CC5=CC=CC=C5)=NN13;