Vitas-M small molecule compound
N-(2,2,2-trichloro-1-{4-[(Z)-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}ethyl)naphthalene-1-carboxamide
Catalog ID
STK822007
SMILES COc1cc(CCN2C(=S)S/C(=C\c3ccc(cc3)OC(C(Cl)(Cl)Cl)NC(=O)c3cccc4c3cccc4)/C2=O)ccc1OC
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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 C33H27Cl3N2O5S2 MW 702.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27Cl3N2O5S2/c1-41-26-15-12-21(18-27(26)42-2)16-17-38-30(40)28(45-32(38)44)19-20-10-13-23(14-11-20)43-31(33(34,35)36)37-29(39)25-9-5-7-22-6-3-4-8-24(22)25/h3-15,18-19,31H,16-17H2,1-2H3,(H,37,39)/b28-19-InChIKey
GNDUUEAJRLHAFM-USHMODERSA-NSynonyms
COC1=C(C=C(C=C1)CCN2C(=O)C(=CC3=CC=C(C=C3)OC(C(Cl)(Cl)Cl)NC(=O)C4=CC=CC5=CC=CC=C54)SC2=S)OC
COc1cc(CCN2C(=S)SC(=Cc3ccc(cc3)OC(C(Cl)(Cl)Cl)NC(=O)c3cccc4c3cccc4)C2=O)ccc1OC
InChI=1SC33H27Cl3N2O5S2c14126151221(1827(26)422)16173830(40)28(4532(38)44)1920101323(141120)4331(33(3435)36)3729(39)2595722634824(22)25h315181931H1617H212H3(H3739)b2819
MFCD03463181
N(222trichloro1(4((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)ethyl)naphthalene1carboxamide
N(222trichloro1(4((Z)(3(2(34dimethoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenoxy)ethyl)naphthalene1carboxamide
ZINC000097947012
ZINC000097947013
Check stock
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Check stock on Vitas-MAvailable files
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