Vitas-M small molecule compound
(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-(3-nitrobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK235761
SMILES S=C1S/C(=C\c2cccc(c2)[N+](=O)[O-])/C(=O)N1Cc1ccc2c(c1)OCO2
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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 C18H12N2O5S2 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12N2O5S2/c21-17-16(8-11-2-1-3-13(6-11)20(22)23)27-18(26)19(17)9-12-4-5-14-15(7-12)25-10-24-14/h1-8H,9-10H2/b16-8-InChIKey
ZTKJOGLOIGZPQY-PXNMLYILSA-NSynonyms
1019776-36-3(5Z)3(13BENZODIOXOL5YLMETHYL)5((3NITROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3(13benzodioxol5ylmethyl)5(3nitrobenzylidene)2thioxo13thiazolidin4one
(Z)3(benzo(d)(13)dioxol5ylmethyl)5(3nitrobenzylidene)2thioxothiazolidin4one
1019776363
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))SC3=S
InChI=1SC18H12N2O5S2c211716(81121313(611)20(22)23)2718(26)19(17)912451415(712)25102414h18H910H2b168
MFCD03213064
S=C1SC(=Cc2cccc(c2)(N+)(=O)(O))C(=O)N1Cc1ccc2c(c1)OCO2
ZINC000013547382
ZINC13547382
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