Vitas-M small molecule compound
N-cyclopropyl-1-[6-({2-[(4-ethylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL083971
SMILES CCc1ccc(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 C21H22N6O2S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O2S/c1-2-14-3-5-15(6-4-14)24-19(28)12-30-20-11-18(22-13-23-20)27-10-9-17(26-27)21(29)25-16-7-8-16/h3-6,9-11,13,16H,2,7-8,12H2,1H3,(H,24,28)(H,25,29)InChIKey
VZQHPATWLFMYGM-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
InChI=1SC21H22N6O2Sc12143515(6414)2419(28)1230201118(22132320)2710917(2627)21(29)25167816h369111316H27812H21H3(H2428)(H2529)
MFCD18202541
Ncyclopropyl1(6((2((4ethylphenyl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2(4ethylanilino)2oxoethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000057520124
ZINC57520124
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