Vitas-M small molecule compound

methyl 4-carbamoyl-5-[(4-{[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butanoyl)amino]-3-methylthiophene-2-carboxylate

Catalog ID
STK340323
SMILES COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)CCCS(=O)(=O)c1nc(cc(n1)C(F)(F)F)c1ccccc1OC

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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 C24H23F3N4O7S2 MW 600.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23F3N4O7S2/c1-12-18(20(28)33)21(39-19(12)22(34)38-3)31-17(32)9-6-10-40(35,36)23-29-14(11-16(30-23)24(25,26)27)13-7-4-5-8-15(13)37-2/h4-5,7-8,11H,6,9-10H2,1-3H3,(H2,28,33)(H,31,32)
InChIKey
JVSVSRWJIXKKQS-UHFFFAOYSA-N
Synonyms
442863-37-8
442863378
CC1=C(SC(=C1C(=O)N)NC(=O)CCCS(=O)(=O)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3OC)C(=O)OC
InChI=1SC24H23F3N4O7S2c11218(20(28)33)21(3919(12)22(34)383)3117(32)961040(3536)232914(1116(3023)24(2526)27)13745815(13)372h457811H6910H213H3(H22833)(H3132)
methyl4carbamoyl5((4((4(2methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonyl)butanoyl)amino)3methylthiophene2carboxylate
METHYL4CARBAMOYL5(4((6(2METHOXYPHENYL)4(TRIFLUOROMETHYL)PYRIMIDIN2YL)SULFONYL)BUTANOYLAMINO)3METHYLTHIOPHENE2CARBOXYLATE
methyl4carbamoyl5(4(4(2methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)sulfonylbutanoylamino)3methylthiophene2carboxylate
MFCD06164162
ZINC000004176721
ZINC4176721

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.