Product Code

TRC-M225937

CAS Number

1246819-66-8

Product Format

Neat

Molecular Formula

C23 D4 H28 N6 O4 S

Molecular Weight

492.628

Product Categories

TRC, Stable isotopes, API Reference Standards & Research Materials

Product Type

Impurity, Stable Isotope Labelled

Unlabelled CAS Number

496835-35-9

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Methisosildenafil-d4

CAS Number

1246819-66-8

Molecular Formula

C23 D4 H28 N6 O4 S

Molecular Weight

492.628

Accurate Mass

492.246

SMILES

[2H]C1([2H])[C@H](C)N[C@H](C)C([2H])([2H])N1S(=O)(=O)c2ccc(OCC)c(c2)C3=NC(=O)c4c(N3)c(CCC)nn4C

InChI

InChI=1S/C23H32N6O4S/c1-6-8-18-20-21(28(5)27-18)23(30)26-22(25-20)17-11-16(9-10-19(17)33-7-2)34(31,32)29-12-14(3)24-15(4)13-29/h9-11,14-15,24H,6-8,12-13H2,1-5H3,(H,25,26,30)/t14-,15+/i12D2,13D2

IUPAC

5-[2-ethoxy-5-[(3R,5S)-2,2,6,6-tetradeuterio-3,5-dimethylpiperazin-1-yl]sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Unlabelled CAS Number

496835-35-9

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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