Vitas-M small molecule compound
4-methoxy-N-[2,2,2-trichloro-1-(4-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)ethyl]benzamide
Catalog ID
STK861670
SMILES COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCc1ccccc1
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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 C28H23Cl3N2O4S2 MW 621.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23Cl3N2O4S2/c1-36-21-13-9-20(10-14-21)24(34)32-26(28(29,30)31)37-22-11-7-19(8-12-22)17-23-25(35)33(27(38)39-23)16-15-18-5-3-2-4-6-18/h2-14,17,26H,15-16H2,1H3,(H,32,34)/b23-17-InChIKey
IETXTTCGSKMYTI-QJOMJCCJSA-NSynonyms
4methoxyN(222trichloro1(4((Z)(4oxo3(2phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)ethyl)benzamide
4methoxyN(222trichloro1(4((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)ethyl)benzamide
COC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)OC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4
COc1ccc(cc1)C(=O)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)CCc1ccccc1
InChI=1SC28H23Cl3N2O4S2c1362113920(101421)24(34)3226(28(2930)31)372211719(81222)172325(35)33(27(38)3923)1615185324618h2141726H1516H21H3(H3234)b2317
MFCD01458651
ZINC000097947048
ZINC000097947049
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