Vitas-M small molecule compound
3-methyl-N-[2,2,2-trichloro-1-(4-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)ethyl]butanamide
Catalog ID
STK822022
SMILES CC(N1C(=S)S/C(=C\c2ccc(cc2)OC(C(Cl)(Cl)Cl)NC(=O)CC(C)C)/C1=O)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 C25H25Cl3N2O3S2 MW 571.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25Cl3N2O3S2/c1-15(2)13-21(31)29-23(25(26,27)28)33-19-11-9-17(10-12-19)14-20-22(32)30(24(34)35-20)16(3)18-7-5-4-6-8-18/h4-12,14-16,23H,13H2,1-3H3,(H,29,31)/b20-14-InChIKey
PDFSDZIBBXUTIZ-ZHZULCJRSA-NSynonyms
3methylN(222trichloro1(4((Z)(4oxo3(1phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)ethyl)butanamide
3methylN(222trichloro1(4((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenoxy)ethyl)butanamide
CC(C)CC(=O)NC(C(Cl)(Cl)Cl)OC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C(C)C3=CC=CC=C3
CC(N1C(=S)SC(=Cc2ccc(cc2)OC(C(Cl)(Cl)Cl)NC(=O)CC(C)C)C1=O)c1ccccc1
InChI=1SC25H25Cl3N2O3S2c115(2)1321(31)2923(25(2627)28)331911917(101219)142022(32)30(24(34)3520)16(3)187546818h412141623H13H213H3(H2931)b2014
MFCD01457934
ZINC000097947036
ZINC000097947039
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