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Product Overview

Product Code

TRC-V118500

CAS Number

918504-65-1

Product Format

Neat

Molecular Formula

C23 H18 Cl F2 N3 O3 S

Molecular Weight

489.92

API Family

Vemurafenib

Product Categories

TRC, Enzyme inhibitors, API Reference Standards & Research Materials, Enzyme inhibitors, Kinase Modulators

Product Type

API

Documentation

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Product Information

Chemical Data

Analyte Name

Vemurafenib

CAS Number

918504-65-1

Molecular Formula

C23 H18 Cl F2 N3 O3 S

Molecular Weight

489.92

Accurate Mass

489.0725

SMILES

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)c4ccc(Cl)cc4)c1F

InChI

InChI=1S/C23H18ClF2N3O3S/c1-2-9-33(31,32)29-19-8-7-18(25)20(21(19)26)22(30)17-12-28-23-16(17)10-14(11-27-23)13-3-5-15(24)6-4-13/h3-8,10-12,29H,2,9H2,1H3,(H,27,28)

IUPAC

N-[3-[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl]propane-1-sulfonamide

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Vemurafenib

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