Vitas-M small molecule compound

methyl 2-[(2-{[(2-ethoxyphenyl)carbonyl]amino}-1,1,1,3,3,3-hexafluoropropan-2-yl)amino]-4-ethyl-5-methylthiophene-3-carboxylate

Catalog ID
STK537903
SMILES CCOc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc(c(c1C(=O)OC)CC)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 C21H22F6N2O4S MW 512.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F6N2O4S/c1-5-12-11(3)34-17(15(12)18(31)32-4)29-19(20(22,23)24,21(25,26)27)28-16(30)13-9-7-8-10-14(13)33-6-2/h7-10,29H,5-6H2,1-4H3,(H,28,30)
InChIKey
PXZAVWWCZPWJSI-UHFFFAOYSA-N
Synonyms

CCC1=C(SC(=C1C(=O)OC)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C2=CC=CC=C2OCC)C
InChI=1SC21H22F6N2O4Sc151211(3)3417(15(12)18(31)324)2919(20(2223)2421(2526)27)2816(30)139781014(13)3362h71029H56H214H3(H2830)
methyl2((2(((2ethoxyphenyl)carbonyl)amino)111333hexafluoropropan2yl)amino)4ethyl5methylthiophene3carboxylate
methyl2((2((2ethoxybenzoyl)amino)111333hexafluoropropan2yl)amino)4ethyl5methylthiophene3carboxylate
methyl2((2(2ethoxybenzamido)111333hexafluoropropan2yl)amino)4ethyl5methylthiophene3carboxylate
MFCD02647493
ZINC000002304131
ZINC02304131
ZINC2304131

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Available files

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