Vitas-M small molecule compound

1-[6-({2-[(3-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-N-cyclopropyl-1H-pyrazole-3-carboxamide

Catalog ID
STL084008
SMILES O=C(Nc1cccc(c1C)Cl)CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1

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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 C20H19ClN6O2S MW 442.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN6O2S/c1-12-14(21)3-2-4-15(12)25-18(28)10-30-19-9-17(22-11-23-19)27-8-7-16(26-27)20(29)24-13-5-6-13/h2-4,7-9,11,13H,5-6,10H2,1H3,(H,24,29)(H,25,28)
InChIKey
KXAMEOBOCIGJIG-UHFFFAOYSA-N
Synonyms
1251621-40-5
1(6((2((3chloro2methylphenyl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)Ncyclopropyl1Hpyrazole3carboxamide
1(6((2((3CHLORO2METHYLPHENYL)AMINO)2OXOETHYL)THIO)PYRIMIDIN4YL)NCYCLOPROPYL1HPYRAZOLE3CARBOXAMIDE
1(6(2(3chloro2methylanilino)2oxoethyl)sulfanylpyrimidin4yl)Ncyclopropylpyrazole3carboxamide
1251621405
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
InChI=1SC20H19ClN6O2Sc11214(21)32415(12)2518(28)103019917(22112319)278716(2627)20(29)24135613h24791113H5610H21H3(H2429)(H2528)
MFCD18202578
ZINC000049404396
ZINC49404396

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Available files

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