Vitas-M small molecule compound
methyl {5-amino-8-(benzylcarbamoyl)-6-cyano-3-oxo-7-[4-(trifluoromethyl)phenyl]-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl}acetate
Catalog ID
STL448109
SMILES COC(=O)CC1SC2=C(C(=O)NCc3ccccc3)C(C(=C(N2C1=O)N)C#N)c1ccc(cc1)C(F)(F)F
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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 C26H21F3N4O4S MW 542.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21F3N4O4S/c1-37-19(34)11-18-24(36)33-22(31)17(12-30)20(15-7-9-16(10-8-15)26(27,28)29)21(25(33)38-18)23(35)32-13-14-5-3-2-4-6-14/h2-10,18,20H,11,13,31H2,1H3,(H,32,35)InChIKey
CHLJVGLNLSIDIX-UHFFFAOYSA-NSynonyms
COC(=O)CC1C(=O)N2C(=C(C(C(=C2S1)C(=O)NCC3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F)C#N)N
InChI=1SC26H21F3N4O4Sc13719(34)111824(36)3322(31)17(1230)20(157916(10815)26(2728)29)21(25(33)3818)23(35)3213145324614h2101820H111331H21H3(H3235)
methyl(5amino8(benzylcarbamoyl)6cyano3oxo7(4(trifluoromethyl)phenyl)23dihydro7H(13)thiazolo(32a)pyridin2yl)acetate
METHYL2(5AMINO8(BENZYLCARBAMOYL)6CYANO3OXO7(4(TRIFLUOROMETHYL)PHENYL)37DIHYDRO2HTHIAZOLO(32A)PYRIDIN2YL)ACETATE
METHYL2(5AMINO8(BENZYLCARBAMOYL)6CYANO3OXO7(4(TRIFLUOROMETHYL)PHENYL)7H(13)THIAZOLO(32A)PYRIDIN2YL)ACETATE
MFCD07773599
ZINC000003764197
ZINC000003764200
Check stock
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Check stock on Vitas-MAvailable files
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