Vitas-M small molecule compound

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

Catalog ID
STL084014
SMILES O=C(CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1)NCCc1ccc(cc1)Cl

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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 C21H21ClN6O2S MW 456.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN6O2S/c22-15-3-1-14(2-4-15)7-9-23-19(29)12-31-20-11-18(24-13-25-20)28-10-8-17(27-28)21(30)26-16-5-6-16/h1-4,8,10-11,13,16H,5-7,9,12H2,(H,23,29)(H,26,30)
InChIKey
ORDCRCHBLXNMHU-UHFFFAOYSA-N
Synonyms

1(6((2((2(4chlorophenyl)ethyl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)Ncyclopropyl1Hpyrazole3carboxamide
1(6(2(2(4chlorophenyl)ethylamino)2oxoethyl)sulfanylpyrimidin4yl)Ncyclopropylpyrazole3carboxamide
C1CC1NC(=O)C2=NN(C=C2)C3=CC(=NC=N3)SCC(=O)NCCC4=CC=C(C=C4)Cl
InChI=1SC21H21ClN6O2Sc22153114(2415)792319(29)1231201118(24132520)2810817(2728)21(30)26165616h14810111316H57912H2(H2329)(H2630)
MFCD18202584
ZINC000057520265
ZINC57520265

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Available files

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