Vitas-M small molecule compound

2-[5-(diethylamino)-2-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy]-N-(3-nitrophenyl)acetamide

Catalog ID
STL419160
SMILES CCN(c1ccc(c(c1)OCC(=O)Nc1cccc(c1)[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C)CC

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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 C30H30N4O5S2 MW 590.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O5S2/c1-5-32(6-2)23-13-11-21(15-27-29(36)33(30(40)41-27)24-12-10-19(3)20(4)14-24)26(17-23)39-18-28(35)31-22-8-7-9-25(16-22)34(37)38/h7-17H,5-6,18H2,1-4H3,(H,31,35)/b27-15+
InChIKey
WFWJZTGVMKGKGU-JFLMPSFJSA-N
Synonyms

2(5(diethylamino)2((E)(3(34dimethylphenyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)N(3nitrophenyl)acetamide
2(5(diethylamino)2((E)(3(34dimethylphenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenoxy)N(3nitrophenyl)acetamide
CCN(c1ccc(c(c1)OCC(=O)Nc1cccc(c1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)c1ccc(c(c1)C)C)CC
CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)C)C)OCC(=O)NC4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC30H30N4O5S2c1532(62)23131121(152729(36)33(30(40)4127)24121019(3)20(4)1424)26(1723)391828(35)312287925(1622)34(37)38h717H5618H214H3(H3135)b2715+
MFCD03614260
ZINC000100323003
ZINC100323003

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Available files

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