Vitas-M small molecule compound
N-cyclopropyl-1-[6-({2-[(2,3-dimethoxybenzyl)amino]-2-oxoethyl}sulfanyl)pyrimidin-4-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL084019
SMILES COc1c(cccc1OC)CNC(=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 C22H24N6O4S MW 468.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O4S/c1-31-17-5-3-4-14(21(17)32-2)11-23-19(29)12-33-20-10-18(24-13-25-20)28-9-8-16(27-28)22(30)26-15-6-7-15/h3-5,8-10,13,15H,6-7,11-12H2,1-2H3,(H,23,29)(H,26,30)InChIKey
SIFNKRPZGKSWQO-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1OC)CNC(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
InChI=1SC22H24N6O4Sc1311753414(21(17)322)112319(29)1233201018(24132520)289816(2728)22(30)26156715h358101315H671112H212H3(H2329)(H2630)
MFCD18202589
Ncyclopropyl1(6((2((23dimethoxybenzyl)amino)2oxoethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2((23dimethoxyphenyl)methylamino)2oxoethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000057520284
ZINC57520284
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