Vitas-M small molecule compound
2-chloro-N-[(5Z)-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
Catalog ID
STK701458
SMILES CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)NC(=O)c1ccccc1Cl)c1ccccc1
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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 C28H21ClN4O3S2 MW 561.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClN4O3S2/c1-2-36-21-14-12-18(13-15-21)25-19(17-32(30-25)20-8-4-3-5-9-20)16-24-27(35)33(28(37)38-24)31-26(34)22-10-6-7-11-23(22)29/h3-17H,2H2,1H3,(H,31,34)/b24-16-InChIKey
AOVNXQWQNCNTTG-JLPGSUDCSA-NSynonyms
2chloroN((5Z)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)benzamide
2CHLORON((5Z)5((3(4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZAMIDE
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)NC(=O)C4=CC=CC=C4Cl)C5=CC=CC=C5
CCOc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)NC(=O)c1ccccc1Cl)c1ccccc1
InChI=1SC28H21ClN4O3S2c123621141218(131521)2519(1732(3025)208435920)162427(35)33(28(37)3824)3126(34)2210671123(22)29h317H2H21H3(H3134)b2416
MFCD03461469
ZINC000002688164
ZINC2688164
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