Vitas-M small molecule compound
ethyl 4-{[({6-[3-(cyclopropylcarbamoyl)-1H-pyrazol-1-yl]pyrimidin-4-yl}sulfanyl)acetyl]amino}piperidine-1-carboxylate
Catalog ID
STL084552
SMILES CCOC(=O)N1CCC(CC1)NC(=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 C21H27N7O4S MW 473.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N7O4S/c1-2-32-21(31)27-8-5-15(6-9-27)24-18(29)12-33-19-11-17(22-13-23-19)28-10-7-16(26-28)20(30)25-14-3-4-14/h7,10-11,13-15H,2-6,8-9,12H2,1H3,(H,24,29)(H,25,30)InChIKey
UXPWRMHKMBJPCB-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC(CC1)NC(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
ethyl4((((6(3(cyclopropylcarbamoyl)1Hpyrazol1yl)pyrimidin4yl)sulfanyl)acetyl)amino)piperidine1carboxylate
ethyl4((2(6(3(cyclopropylcarbamoyl)pyrazol1yl)pyrimidin4yl)sulfanylacetyl)amino)piperidine1carboxylate
InChI=1SC21H27N7O4Sc123221(31)278515(6927)2418(29)1233191117(22132319)2810716(2628)20(30)25143414h710111315H268912H21H3(H2429)(H2530)
MFCD18203116
ZINC000057522412
ZINC57522412
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