Vitas-M small molecule compound
(5Z)-3-(4-methoxybenzyl)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK014091
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2cccc(c2)[N+](=O)[O-])/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 C18H14N2O4S2 MW 386.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S2/c1-24-15-7-5-12(6-8-15)11-19-17(21)16(26-18(19)25)10-13-3-2-4-14(9-13)20(22)23/h2-10H,11H2,1H3/b16-10-InChIKey
KXBPATANFRTVFZ-YBEGLDIGSA-NSynonyms
(5Z)3((4METHOXYPHENYL)METHYL)5((3NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(4METHOXYBENZYL)5(3NITROBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
COC1=CC=C(C=C1)CN2C(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))SC2=S
COc1ccc(cc1)CN1C(=S)SC(=Cc2cccc(c2)(N+)(=O)(O))C1=O
InChI=1SC18H14N2O4S2c124157512(6815)111917(21)16(2618(19)25)101332414(913)20(22)23h210H11H21H3b1610
MFCD03137200
STK014091
ZINC000001178206
ZINC01178206
ZINC1178206
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