Vitas-M small molecule compound
N-cyclopropyl-1-[6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL083985
SMILES O=C(Nc1ccccc1C)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 C20H20N6O2S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O2S/c1-13-4-2-3-5-15(13)24-18(27)11-29-19-10-17(21-12-22-19)26-9-8-16(25-26)20(28)23-14-6-7-14/h2-5,8-10,12,14H,6-7,11H2,1H3,(H,23,28)(H,24,27)InChIKey
UDGOFTLDZUWCHV-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1NC(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
InChI=1SC20H20N6O2Sc113423515(13)2418(27)1129191017(21122219)269816(2526)20(28)23146714h258101214H6711H21H3(H2328)(H2427)
MFCD18202555
Ncyclopropyl1(6((2((2methylphenyl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2(2methylanilino)2oxoethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000057520182
ZINC57520182
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