Name: A-1331852
Brand: TRC
SKU: TRC-A100900

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Product Overview

Product Code

TRC-A100900

CAS Number

1430844-80-6

Product Format

Neat

Molecular Formula

C38H38N6O3S

Molecular Weight

658.81

Product Categories

Bioactive small molecules, Apoptosis, TRC

Product Type

Native/Parent, Bioactive Small Molecule

Documentation

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Product Information

Analyte Name

A-1331852

CAS Number

1430844-80-6

Molecular Formula

C38H38N6O3S

Molecular Weight

658.81

Accurate Mass

658.2726

SMILES

O=C(C1=NC(N2CC3=C(C=CC=C3C(NC4=NC5=CC=CC=C5S4)=O)CC2)=CC=C1C6=C(C)N(CC78CC9CC(C8)CC(C9)C7)N=C6)O

InChI

InChI=1S/C38H38N6O3S/c1-22-29(19-39-44(22)21-38-16-23-13-24(17-38)15-25(14-23)18-38)27-9-10-33(41-34(27)36(46)47)43-12-11-26-5-4-6-28(30(26)20-43)35(45)42-37-40-31-7-2-3-8-32(31)48-37/h2-10,19,23-25H,11-18,20-21H2,1H3,(H,46,47)(H,40,42,45)

IUPAC

3-[1-(1-adamantylmethyl)-5-methylpyrazol-4-yl]-6-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydro-1H-isoquinolin-2-yl]pyridine-2-carboxylic acid

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Native/Parent; Bioactive Small Molecule

Product Format

Neat

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