Vitas-M small molecule compound

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

Catalog ID
STL346993
SMILES COc1cc(Cl)c(cc1NC(=O)CSc1ncnc2c1cnn2c1ccccc1)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 C21H18ClN5O2S MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O2S/c1-13-8-17(18(29-2)9-16(13)22)26-19(28)11-30-21-15-10-25-27(20(15)23-12-24-21)14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,26,28)
InChIKey
ORBCPEGGOUMJMM-UHFFFAOYSA-N
Synonyms
587012-67-7
587012677
CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4
InChI=1SC21H18ClN5O2Sc113817(18(292)916(13)22)2619(28)11302115102527(20(15)23122421)146435714h31012H11H212H3(H2628)
MFCD04034277
N(4chloro2methoxy5methylphenyl)2((1phenyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)acetamide
N(4chloro2methoxy5methylphenyl)2((1phenyl1Hpyrazolo(34d)pyrimidin4yl)thio)acetamide
N(4CHLORO2METHOXY5METHYLPHENYL)2(1PHENYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLACETAMIDE
ZINC000002450461
ZINC02450461
ZINC2450461

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Available files

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