Vitas-M small molecule compound

(5E)-5-[4-(prop-2-en-1-yloxy)benzylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

Catalog ID
STK066323
SMILES C=CCOc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)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 C16H13NO3S MW 299.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO3S/c1-3-9-17-15(18)14(21-16(17)19)11-12-5-7-13(8-6-12)20-10-4-2/h1,4-8,11H,2,9-10H2/b14-11+
InChIKey
OYPMSDXIEZFXLT-SDNWHVSQSA-N
Synonyms

(5E)5((4prop2enoxyphenyl)methylidene)3prop2ynyl13thiazolidine24dione
(5E)5(4(PROP2EN1YLOXY)BENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
C=CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC#C
C=CCOc1ccc(cc1)C=C1SC(=O)N(C1=O)CC#C
InChI=1SC16H13NO3Sc1391715(18)14(2116(17)19)11125713(8612)201042h14811H2910H2b1411+
MFCD03728239
STK066323
ZINC000013897839
ZINC13897839

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.