Vitas-M small molecule compound
N-[2,2,2-trichloro-1-(4-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)ethyl]cyclohexa-1,3-diene-1-carboxamide
Catalog ID
STK822023
SMILES O=C(C1=CC=CCC1)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 C27H23Cl3N2O3S2 MW 593.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23Cl3N2O3S2/c28-27(29,30)25(31-23(33)20-9-5-2-6-10-20)35-21-13-11-19(12-14-21)17-22-24(34)32(26(36)37-22)16-15-18-7-3-1-4-8-18/h1-5,7-9,11-14,17,25H,6,10,15-16H2,(H,31,33)/b22-17-InChIKey
WXJRSHDVKBROKS-XLNRJJMWSA-NSynonyms
C1CC(=CC=C1)C(=O)NC(C(Cl)(Cl)Cl)OC2=CC=C(C=C2)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4
InChI=1SC27H23Cl3N2O3S2c2827(2930)25(3123(33)2095261020)3521131119(121421)172224(34)32(26(36)3722)1615187314818h157911141725H6101516H2(H3133)b2217
MFCD03463196
N(222trichloro1(4((Z)(4oxo3(2phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)ethyl)cyclohexa13diene1carboxamide
N(222trichloro1(4((Z)(4oxo3(2phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)ethyl)cyclohexa13diene1carboxamide
O=C(C1=CC=CCC1)NC(C(Cl)(Cl)Cl)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)CCc1ccccc1
ZINC000097947042
ZINC000097947043
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