Vitas-M small molecule compound

(5Z)-3-(3-nitrobenzyl)-5-[4-(prop-2-en-1-yloxy)benzylidene]-1,3-thiazolidine-2,4-dione

Catalog ID
STK157471
SMILES C=CCOc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[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 C20H16N2O5S MW 396.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O5S/c1-2-10-27-17-8-6-14(7-9-17)12-18-19(23)21(20(24)28-18)13-15-4-3-5-16(11-15)22(25)26/h2-9,11-12H,1,10,13H2/b18-12-
InChIKey
MGONLYRRLCKDDT-PDGQHHTCSA-N
Synonyms

(5Z)3((3NITROPHENYL)METHYL)5((4PROP2ENOXYPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5Z)3(3NITROBENZYL)5(4(PROP2EN1YLOXY)BENZYLIDENE)13THIAZOLIDINE24DIONE
C=CCOC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)(N+)(=O)(O)
C=CCOc1ccc(cc1)C=C1SC(=O)N(C1=O)Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC20H16N2O5Sc121027178614(7917)121819(23)21(20(24)2818)131543516(1115)22(25)26h291112H11013H2b1812
MFCD03729728
ZINC000013546605
ZINC13546605

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Available files

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