Vitas-M small molecule compound
[(5Z)-5-{2-[(2-chlorobenzyl)oxy]-5-nitrobenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK583481
SMILES OC(=O)CN1C(=S)S/C(=C\c2cc(ccc2OCc2ccccc2Cl)[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 C19H13ClN2O6S2 MW 464.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClN2O6S2/c20-14-4-2-1-3-11(14)10-28-15-6-5-13(22(26)27)7-12(15)8-16-18(25)21(9-17(23)24)19(29)30-16/h1-8H,9-10H2,(H,23,24)/b16-8-InChIKey
QVPKEZUIXWDLBG-PXNMLYILSA-NSynonyms
613218-85-2((5Z)5(2((2chlorobenzyl)oxy)5nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(5(2((2chlorobenzyl)oxy)5nitrobenzylidene)4oxo2thioxothiazolidin3yl)aceticacid
2((5Z)5((2((2CHLOROPHENYL)METHOXY)5NITROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
613218852
C1=CC=C(C(=C1)COC2=C(C=C(C=C2)(N+)(=O)(O))C=C3C(=O)N(C(=S)S3)CC(=O)O)Cl
InChI=1SC19H13ClN2O6S2c2014421311(14)1028156513(22(26)27)712(15)81618(25)21(917(23)24)19(29)3016h18H910H2(H2324)b168
MFCD03678593
OC(=O)CN1C(=S)SC(=Cc2cc(ccc2OCc2ccccc2Cl)(N+)(=O)(O))C1=O
ZINC000001889481
ZINC1889481
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