Vitas-M small molecule compound
3-[(5E)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)propanamide
Catalog ID
STK994297
SMILES CCc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)Nc1ccc(cc1)[N+](=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 C21H19N3O4S2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S2/c1-2-14-3-5-15(6-4-14)13-18-20(26)23(21(29)30-18)12-11-19(25)22-16-7-9-17(10-8-16)24(27)28/h3-10,13H,2,11-12H2,1H3,(H,22,25)/b18-13+InChIKey
DFYQWNZJFAJQAF-QGOAFFKASA-NSynonyms
3((5E)5((4ETHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(4NITROPHENYL)PROPANAMIDE
3((5E)5(4ethylbenzylidene)4oxo2thioxo13thiazolidin3yl)N(4nitrophenyl)propanamide
CCC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC=C(C=C3)(N+)(=O)(O)
CCc1ccc(cc1)C=C1SC(=S)N(C1=O)CCC(=O)Nc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H19N3O4S2c12143515(6414)131820(26)23(21(29)3018)121119(25)22167917(10816)24(27)28h31013H21112H21H3(H2225)b1813+
MFCD02634880
ZINC000022171108
ZINC22171108
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