Analyte Name

5-((5-(6,13-dimethyl-2-tricyclo(9.4.0.03,8)pentadeca-1(11),3(8),4,6,9,12,14-heptaenyl)-2-oxo-4-sulfanylidenepyrimidin-1-yl)methyl)-N-(1H-tetrazol-5-yl)furan-2-carboxamide

CAS Number

216657-60-2

Molecular Formula

C28 H23 N7 O3 S

Molecular Weight

537.592

Accurate Mass

537.158

SMILES

Cc1ccc2C(C3=CN(Cc4oc(cc4)C(=O)Nc5nnn[nH]5)C(=O)NC3=S)c6ccc(C)cc6C=Cc2c1

InChI

InChI=1S/C28H23N7O3S/c1-15-3-8-20-17(11-15)5-6-18-12-16(2)4-9-21(18)24(20)22-14-35(28(37)30-26(22)39)13-19-7-10-23(38-19)25(36)29-27-31-33-34-32-27/h3-12,14,24H,13H2,1-2H3,(H,30,37,39)(H2,29,31,32,33,34,36)

IUPAC

5-[[5-(6,13-dimethyl-2-tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaenyl)-2-oxo-4-sulfanylidenepyrimidin-1-yl]methyl]-N-(1H-tetrazol-5-yl)furan-2-carboxamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive Small Molecule

Product Format

Neat