Vitas-M small molecule compound
4-{(5Z)-5-[(2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK994099
SMILES OC(=O)CCCN1C(=S)S/C(=C\C=C\c2ccccc2[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 C16H14N2O5S2 MW 378.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5S2/c19-14(20)9-4-10-17-15(21)13(25-16(17)24)8-3-6-11-5-1-2-7-12(11)18(22)23/h1-3,5-8H,4,9-10H2,(H,19,20)/b6-3+,13-8-InChIKey
WJXGNLIZOPKOAN-HUHFURAHSA-NSynonyms
301688-79-9301688799
4((5Z)5((2E)3(2nitrophenyl)prop2en1ylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((E)3(2NITROPHENYL)PROP2ENYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4(5((2E)3(2NITROPHENYL)PROP2ENYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
C1=CC=C(C(=C1)C=CC=C2C(=O)N(C(=S)S2)CCCC(=O)O)(N+)(=O)(O)
InChI=1SC16H14N2O5S2c1914(20)94101715(21)13(2516(17)24)83611512712(11)18(22)23h1358H4910H2(H1920)b63+138
MFCD01910882
OC(=O)CCCN1C(=S)SC(=CC=Cc2ccccc2(N+)(=O)(O))C1=O
ZINC000015357261
ZINC15357261
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