Vitas-M small molecule compound
2-{(5Z)-5-[(2Z)-2-chloro-3-(4-nitrophenyl)prop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanedioic acid
Catalog ID
STK737697
SMILES OC(=O)CC(N1C(=S)S/C(=C\C(=C\c2ccc(cc2)[N+](=O)[O-])\Cl)/C1=O)C(=O)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 C16H11ClN2O7S2 MW 442.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O7S2/c17-9(5-8-1-3-10(4-2-8)19(25)26)6-12-14(22)18(16(27)28-12)11(15(23)24)7-13(20)21/h1-6,11H,7H2,(H,20,21)(H,23,24)/b9-5-,12-6-InChIKey
KPFAYZOKNVQHFR-QIRVBYKSSA-NSynonyms
2((5Z)5((2Z)2chloro3(4nitrophenyl)prop2en1ylidene)4oxo2thioxo13thiazolidin3yl)butanedioicacid
2((5Z)5((Z)2CHLORO3(4NITROPHENYL)PROP2ENYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANEDIOICACID
2((Z)5((Z)2chloro3(4nitrophenyl)allylidene)4oxo2thioxothiazolidin3yl)succinicacid
2(5((2Z)2CHLORO3(4NITROPHENYL)PROP2ENYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANEDIOICACID
C1=CC(=CC=C1C=C(C=C2C(=O)N(C(=S)S2)C(CC(=O)O)C(=O)O)Cl)(N+)(=O)(O)
InChI=1SC16H11ClN2O7S2c179(581310(428)19(25)26)61214(22)18(16(27)2812)11(15(23)24)713(20)21h1611H7H2(H2021)(H2324)b95126
MFCD01910681
OC(=O)CC(N1C(=S)SC(=CC(=Cc2ccc(cc2)(N+)(=O)(O))Cl)C1=O)C(=O)O
ZINC000009075780
ZINC000032508930
Check stock
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