Vitas-M small molecule compound
N-cyclopropyl-1-[6-({2-[(5-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL084548
SMILES CCOc1ccc2c(c1)nc(s2)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 C22H21N7O3S2 MW 495.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7O3S2/c1-2-32-14-5-6-17-16(9-14)26-22(34-17)27-19(30)11-33-20-10-18(23-12-24-20)29-8-7-15(28-29)21(31)25-13-3-4-13/h5-10,12-13H,2-4,11H2,1H3,(H,25,31)(H,26,27,30)InChIKey
JXKWGJSPTKLAGT-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)SC(=N2)NC(=O)CSC3=NC=NC(=C3)N4C=CC(=N4)C(=O)NC5CC5
InChI=1SC22H21N7O3S2c123214561716(914)2622(3417)2719(30)1133201018(23122420)298715(2829)21(31)25133413h5101213H2411H21H3(H2531)(H262730)
MFCD18203112
Ncyclopropyl1(6((2((5ethoxy13benzothiazol2yl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2((5ethoxy13benzothiazol2yl)amino)2oxoethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000067239563
ZINC67239563
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