Vitas-M small molecule compound
(5E)-5-[3-ethoxy-5-(prop-2-en-1-yl)-4-(prop-2-yn-1-yloxy)benzylidene]-3-(prop-2-en-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK155098
SMILES C=CCN1C(=O)S/C(=C/c2cc(OCC)c(c(c2)CC=C)OCC#C)/C1=O
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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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c1-5-9-16-12-15(13-17(25-8-4)19(16)26-11-7-3)14-18-20(23)22(10-6-2)21(24)27-18/h3,5-6,12-14H,1-2,8-11H2,4H3/b18-14+InChIKey
JWTLHACGNNERCG-NBVRZTHBSA-NSynonyms
(5E)5((3ETHOXY5PROP2ENYL4PROP2YNOXYPHENYL)METHYLIDENE)3PROP2ENYL13THIAZOLIDINE24DIONE
(5E)5(3ETHOXY5(PROP2EN1YL)4(PROP2YN1YLOXY)BENZYLIDENE)3(PROP2EN1YL)13THIAZOLIDINE24DIONE
3ALLYL5(3ALLYL5ETHOXY4(2PROPYNYLOXY)BENZYLIDENE)13THIAZOLIDINE24DIONE
C=CCN1C(=O)SC(=Cc2cc(OCC)c(c(c2)CC=C)OCC#C)C1=O
CCOC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)N(C(=O)S2)CC=C
InChI=1SC21H21NO4Sc159161215(1317(2584)19(16)261173)141820(23)22(1062)21(24)2718h3561214H12811H24H3b1814+
MFCD03784134
ZINC000002116948
ZINC02116948
ZINC2116948
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