Vitas-M small molecule compound

4-[(5E)-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid

Catalog ID
STK740853
SMILES OC(=O)CCCN1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)[N+](=O)[O-])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 C19H16N2O6S2 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O6S2/c1-11-4-5-12(9-14(11)21(25)26)15-7-6-13(27-15)10-16-18(24)20(19(28)29-16)8-2-3-17(22)23/h4-7,9-10H,2-3,8H2,1H3,(H,22,23)/b16-10+
InChIKey
IPFMLUHJMNDAHQ-MHWRWJLKSA-N
Synonyms

(Z)4(5((5(4methyl3nitrophenyl)furan2yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
4((5E)5((5(4methyl3nitrophenyl)furan2yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanoicacid
4((5E)5((5(4methyl3nitrophenyl)furan2yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4(5((5(4METHYL3NITROPHENYL)(2FURYL))METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
CC1=C(C=C(C=C1)C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CCCC(=O)O)(N+)(=O)(O)
InChI=1SC19H16N2O6S2c1114512(914(11)21(25)26)157613(2715)101618(24)20(19(28)2916)82317(22)23h47910H238H21H3(H2223)b1610+
MFCD07802280
OC(=O)CCCN1C(=S)SC(=Cc2ccc(o2)c2ccc(c(c2)(N+)(=O)(O))C)C1=O
ZINC000012414289
ZINC12414289

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Available files

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