Vitas-M small molecule compound
2-chloro-4-methyl-N-{(5E)-5-[2-(morpholin-4-yl)-5-nitrobenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Catalog ID
STL370055
SMILES Cc1ccc(c(c1)Cl)C(=O)NN1C(=S)S/C(=C/c2cc(ccc2N2CCOCC2)[N+](=O)[O-])/C1=O
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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 C22H19ClN4O5S2 MW 519.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O5S2/c1-13-2-4-16(17(23)10-13)20(28)24-26-21(29)19(34-22(26)33)12-14-11-15(27(30)31)3-5-18(14)25-6-8-32-9-7-25/h2-5,10-12H,6-9H2,1H3,(H,24,28)/b19-12+InChIKey
HNMVRBDEZGFKON-XDHOZWIPSA-NSynonyms
2chloro4methylN((5E)5((2morpholin4yl5nitrophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)benzamide
2chloro4methylN((5E)5(2(morpholin4yl)5nitrobenzylidene)4oxo2thioxo13thiazolidin3yl)benzamide
CC1=CC(=C(C=C1)C(=O)NN2C(=O)C(=CC3=C(C=CC(=C3)(N+)(=O)(O))N4CCOCC4)SC2=S)Cl
Cc1ccc(c(c1)Cl)C(=O)NN1C(=S)SC(=Cc2cc(ccc2N2CCOCC2)(N+)(=O)(O))C1=O
InChI=1SC22H19ClN4O5S2c1132416(17(23)1013)20(28)242621(29)19(3422(26)33)12141115(27(30)31)3518(14)2568329725h251012H69H21H3(H2428)b1912+
MFCD06760602
ZINC000009235482
ZINC09235482
ZINC9235482
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