Vitas-M small molecule compound
(5E)-3-(butan-2-yl)-5-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK719339
SMILES CCC(N1C(=S)S/C(=C/Nc2ccc3c(c2)OCCO3)/C1=O)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 C16H18N2O3S2 MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S2/c1-3-10(2)18-15(19)14(23-16(18)22)9-17-11-4-5-12-13(8-11)21-7-6-20-12/h4-5,8-10,17H,3,6-7H2,1-2H3/b14-9+InChIKey
MFMONIRTFYOQNL-NTEUORMPSA-NSynonyms
(5E)3(butan2yl)5((23dihydro14benzodioxin6ylamino)methylidene)2thioxo13thiazolidin4one
(5E)3butan2yl5((23dihydro14benzodioxin6ylamino)methylidene)2sulfanylidene13thiazolidin4one
(E)3(secbutyl)5(((23dihydrobenzo(b)(14)dioxin6yl)amino)methylene)2thioxothiazolidin4one
CCC(C)N1C(=O)C(=CNC2=CC3=C(C=C2)OCCO3)SC1=S
CCC(N1C(=S)SC(=CNc2ccc3c(c2)OCCO3)C1=O)C
InChI=1SC16H18N2O3S2c1310(2)1815(19)14(2316(18)22)91711451213(811)21762012h4581017H367H212H3b149+
MFCD09845325
ZINC000009422500
ZINC000009422501
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