Vitas-M small molecule compound
(5E)-5-[4-(butan-2-yloxy)benzylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK054258
SMILES CCC(Oc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CC#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 C17H17NO3S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S/c1-4-10-18-16(19)15(22-17(18)20)11-13-6-8-14(9-7-13)21-12(3)5-2/h1,6-9,11-12H,5,10H2,2-3H3/b15-11+InChIKey
QBLROBCFWCXFSN-RVDMUPIBSA-NSynonyms
(5E)5((4butan2yloxyphenyl)methylidene)3prop2ynyl13thiazolidine24dione
(5E)5(4(BUTAN2YLOXY)BENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
CCC(C)OC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC#C
CCC(Oc1ccc(cc1)C=C1SC(=O)N(C1=O)CC#C)C
InChI=1SC17H17NO3Sc14101816(19)15(2217(18)20)11136814(9713)2112(3)52h1691112H510H223H3b1511+
MFCD03728641
STK054258
ZINC000013943929
ZINC000013943931
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