Vitas-M small molecule compound
methyl 2-[({3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK017673
SMILES COC(=O)c1c(NC(=O)c2cccc(c2)Cn2nc(c(c2C)Cl)C)sc(c1C)C
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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 C21H22ClN3O3S MW 431.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O3S/c1-11-14(4)29-20(17(11)21(27)28-5)23-19(26)16-8-6-7-15(9-16)10-25-13(3)18(22)12(2)24-25/h6-9H,10H2,1-5H3,(H,23,26)InChIKey
JERQRFIZAQEAQL-UHFFFAOYSA-NSynonyms
402722-53-6402722536
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Cl)C)C
COC(=O)c1c(NC(=O)c2cccc(c2)Cn2nc(c(c2C)Cl)C)sc(c1C)C
InChI=1SC21H22ClN3O3Sc11114(4)2920(17(11)21(27)285)2319(26)1686715(916)102513(3)18(22)12(2)2425h69H10H215H3(H2326)
METHYL2(((3((4CHLORO35DIMETHYL1HPYRAZOL1YL)METHYL)PHENYL)CARBONYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((3((4CHLORO35DIMETHYLPYRAZOL1YL)METHYL)BENZOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02055242
STK017673
ZINC000000652237
ZINC00652237
ZINC652237
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