Vitas-M small molecule compound

N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide

Catalog ID
STL348059
SMILES COc1cc(Cl)c(cc1NC(=O)CSc1ncnc2c1cnn2c1ccc(cc1)Cl)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H17Cl2N5O2S MW 474.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N5O2S/c1-12-7-17(18(30-2)8-16(12)23)27-19(29)10-31-21-15-9-26-28(20(15)24-11-25-21)14-5-3-13(22)4-6-14/h3-9,11H,10H2,1-2H3,(H,27,29)
InChIKey
XDFWMMYYWDPPJJ-UHFFFAOYSA-N
Synonyms
577767-14-7
577767147
CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl
InChI=1SC21H17Cl2N5O2Sc112717(18(302)816(12)23)2719(29)1031211592628(20(15)24112521)145313(22)4614h3911H10H212H3(H2729)
MFCD04019077
N(4chloro2methoxy5methylphenyl)2((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)acetamide
N(4chloro2methoxy5methylphenyl)2((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)acetamide
N(4CHLORO2METHOXY5METHYLPHENYL)2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLACETAMIDE
ZINC000009479907
ZINC09479907
ZINC9479907

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Available files

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