FIIN-1

Analyte Name

N-(3-((3-(2,6-dichloro-3,5-dimethoxyphenyl)-7-(4-(diethylamino)butylamino)-2-oxo-4H-pyrimido(4,5-d)pyrimidin-1-yl)methyl)phenyl)prop-2-enamide hydrochloride

CAS Number

1256152-35-8

Molecular Formula

C32 H39 Cl2 N7 O4 . Cl H

Molecular Weight

693.063

Accurate Mass

691.221

SMILES

Cl.CCN(CC)CCCCNc1ncc2CN(C(=O)N(Cc3cccc(NC(=O)C=C)c3)c2n1)c4c(Cl)c(OC)cc(OC)c4Cl

InChI

InChI=1S/C32H39Cl2N7O4.ClH/c1-6-26(42)37-23-13-11-12-21(16-23)19-41-30-22(18-36-31(38-30)35-14-9-10-15-39(7-2)8-3)20-40(32(41)43)29-27(33)24(44-4)17-25(45-5)28(29)34;/h6,11-13,16-18H,1,7-10,14-15,19-20H2,2-5H3,(H,37,42)(H,35,36,38);1H

IUPAC

N-[3-[[3-(2,6-dichloro-3,5-dimethoxyphenyl)-7-[4-(diethylamino)butylamino]-2-oxo-4H-pyrimido[4,5-d]pyrimidin-1-yl]methyl]phenyl]prop-2-enamide;hydrochloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat