Vitas-M small molecule compound
dipropan-2-yl 2-[2,2,6,7-tetramethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK789888
SMILES CC(OC(=O)C1=C(S/C(=C\2/c3cc(C)c(cc3N(C(C2=S)(C)C)C(=O)C(F)(F)F)C)/S1)C(=O)OC(C)C)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 C26H28F3NO5S3 MW 587.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28F3NO5S3/c1-11(2)34-21(31)18-19(22(32)35-12(3)4)38-23(37-18)17-15-9-13(5)14(6)10-16(15)30(24(33)26(27,28)29)25(7,8)20(17)36/h9-12H,1-8H3InChIKey
RYXYKSFQGBHFMF-UHFFFAOYSA-NSynonyms
CC(OC(=O)C1=C(SC(=C2c3cc(C)c(cc3N(C(C2=S)(C)C)C(=O)C(F)(F)F)C)S1)C(=O)OC(C)C)C
CC1=C(C=C2C(=C1)C(=C3SC(=C(S3)C(=O)OC(C)C)C(=O)OC(C)C)C(=S)C(N2C(=O)C(F)(F)F)(C)C)C
diisopropyl2(2267tetramethyl3thioxo1(222trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
dipropan2yl2(2267tetramethyl3sulfanylidene1(222trifluoroacetyl)quinolin4ylidene)13dithiole45dicarboxylate
dipropan2yl2(2267tetramethyl3thioxo1(trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H28F3NO5S3c111(2)3421(31)1819(22(32)3512(3)4)3823(3718)1715913(5)14(6)1016(15)30(24(33)26(2728)29)25(78)20(17)36h912H18H3
MFCD01945867
ZINC000102346188
ZINC102346188
Check stock
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Check stock on Vitas-MAvailable files
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