Vitas-M small molecule compound
N-[(5E)-5-{3-methoxy-4-[(5-nitropyridin-2-yl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]thiophene-2-carboxamide
Catalog ID
STK296474
SMILES COc1cc(ccc1Oc1ccc(cn1)[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)NC(=O)c1cccs1
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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 C21H14N4O6S3 MW 514.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N4O6S3/c1-30-15-9-12(4-6-14(15)31-18-7-5-13(11-22-18)25(28)29)10-17-20(27)24(21(32)34-17)23-19(26)16-3-2-8-33-16/h2-11H,1H3,(H,23,26)/b17-10+InChIKey
IHQWHWLHRJJLFR-LICLKQGHSA-NSynonyms
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CS3)OC4=NC=C(C=C4)(N+)(=O)(O)
COc1cc(ccc1Oc1ccc(cn1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)NC(=O)c1cccs1
InChI=1SC21H14N4O6S3c13015912(4614(15)31187513(112218)25(28)29)101720(27)24(21(32)3417)2319(26)163283316h211H1H3(H2326)b1710+
MFCD04084538
N((5E)5((3METHOXY4(5NITROPYRIDIN2YL)OXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)THIOPHENE2CARBOXAMIDE
N((5E)5(3METHOXY4((5NITROPYRIDIN2YL)OXY)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)THIOPHENE2CARBOXAMIDE
ZINC000100340107
ZINC100340107
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