Vitas-M small molecule compound
2-chloro-N-[(5Z)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Catalog ID
STK809476
SMILES S=C1S/C(=C\c2cn(nc2c2cccc(c2)[N+](=O)[O-])c2ccccc2)/C(=O)N1NC(=O)c1ccccc1Cl
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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 C26H16ClN5O4S2 MW 562.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16ClN5O4S2/c27-21-12-5-4-11-20(21)24(33)29-31-25(34)22(38-26(31)37)14-17-15-30(18-8-2-1-3-9-18)28-23(17)16-7-6-10-19(13-16)32(35)36/h1-15H,(H,29,33)/b22-14-InChIKey
CQOUKKMTXNGUOA-HMAPJEAMSA-NSynonyms
2chloroN((5Z)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)benzamide
2CHLORON((5Z)5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZAMIDE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)(N+)(=O)(O))C=C4C(=O)N(C(=S)S4)NC(=O)C5=CC=CC=C5Cl
InChI=1SC26H16ClN5O4S2c272112541120(21)24(33)293125(34)22(3826(31)37)14171530(188213918)2823(17)16761019(1316)32(35)36h115H(H2933)b2214
MFCD03461372
S=C1SC(=Cc2cn(nc2c2cccc(c2)(N+)(=O)(O))c2ccccc2)C(=O)N1NC(=O)c1ccccc1Cl
ZINC000002682436
ZINC2682436
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