Vitas-M small molecule compound
1-(6-{[2-(butylamino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropyl-1H-pyrazole-3-carboxamide
Catalog ID
STL083966
SMILES CCCCNC(=O)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 C17H22N6O2S MW 374.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6O2S/c1-2-3-7-18-15(24)10-26-16-9-14(19-11-20-16)23-8-6-13(22-23)17(25)21-12-4-5-12/h6,8-9,11-12H,2-5,7,10H2,1H3,(H,18,24)(H,21,25)InChIKey
GQXHQYYVWCSOIR-UHFFFAOYSA-NSynonyms
1(6((2(butylamino)2oxoethyl)sulfanyl)pyrimidin4yl)Ncyclopropyl1Hpyrazole3carboxamide
1(6(2(butylamino)2oxoethyl)sulfanylpyrimidin4yl)Ncyclopropylpyrazole3carboxamide
CCCCNC(=O)CSC1=NC=NC(=C1)N2C=CC(=N2)C(=O)NC3CC3
InChI=1SC17H22N6O2Sc12371815(24)102616914(19112016)238613(2223)17(25)21124512h6891112H25710H21H3(H1824)(H2125)
MFCD18202536
ZINC000057520107
ZINC57520107
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