Vitas-M small molecule compound

(2E)-2-cyano-N-(2,4-dichlorophenyl)-2-[(5E)-5-(4-nitrobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide

Catalog ID
STL040852
SMILES N#C/C(=c/1\s/c(=C/c2ccc(cc2)[N+](=O)[O-])/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(cc1Cl)Cl

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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 C25H14Cl2N4O4S MW 537.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H14Cl2N4O4S/c26-16-8-11-21(20(27)13-16)29-23(32)19(14-28)25-30(17-4-2-1-3-5-17)24(33)22(36-25)12-15-6-9-18(10-7-15)31(34)35/h1-13H,(H,29,32)/b22-12+,25-19+
InChIKey
LDZUZSFECPSHLR-RKPOSHQWSA-N
Synonyms
714943-11-0
(2E)2CYANON(24DICHLOROPHENYL)2((5E)5((4NITROPHENYL)METHYLIDENE)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)ACETAMIDE
(2E)2cyanoN(24dichlorophenyl)2((5E)5(4nitrobenzylidene)4oxo3phenyl13thiazolidin2ylidene)ethanamide
(E)2cyanoN(24dichlorophenyl)2((E)5(4nitrobenzylidene)4oxo3phenylthiazolidin2ylidene)acetamide
714943110
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)(N+)(=O)(O))SC2=C(C#N)C(=O)NC4=C(C=C(C=C4)Cl)Cl
InChI=1SC25H14Cl2N4O4Sc261681121(20(27)1316)2923(32)19(1428)2530(174213517)24(33)22(3625)12156918(10715)31(34)35h113H(H2932)b2212+2519+
MFCD04155667
N#CC(=c1sc(=Cc2ccc(cc2)(N+)(=O)(O))c(=O)n1c1ccccc1)C(=O)Nc1ccc(cc1Cl)Cl
ZINC000101093149
ZINC101093149

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Available files

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