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Product Overview

Product Code

TRC-A794673

Product Format

Neat

Molecular Formula

C23H21D5ClN7O3

Molecular Weight

488.98

Product Categories

TRC, Stable isotopes, API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, API, Contaminant

Unlabelled CAS Number

330784-47-9

Product Information

Chemical Data

Analyte Name

Avanafil-d5

Molecular Formula

C23H21D5ClN7O3

Molecular Weight

488.98

Accurate Mass

488.21

SMILES

ClC1=CC(CNC2=NC(N3CCC[C@H]3CO)=NC=C2C(NC([2H])([2H])C4=NC([2H])=C([2H])C([2H])=N4)=O)=CC=C1OC

InChI

InChI=1S/C23H26ClN7O3/c1-34-19-6-5-15(10-18(19)24)11-27-21-17(22(33)28-13-20-25-7-3-8-26-20)12-29-23(30-21)31-9-2-4-16(31)14-32/h3,5-8,10,12,16,32H,2,4,9,11,13-14H2,1H3,(H,28,33)(H,27,29,30)/t16-/m0/s1/i3D,7D,8D,13D2

IUPAC

(S)-4-((3-chloro-4-methoxybenzyl)amino)-2-(2-(hydroxymethyl)pyrrolidin-1-yl)-N-((pyrimidin-2-yl-d3)methyl-d2)pyrimidine-5-carboxamide

Unlabelled CAS Number

330784-47-9

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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