Vitas-M small molecule compound

(2E)-2-cyano-2-[5-(4-methoxybenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(4-methylpiperazin-1-yl)ethanamide

Catalog ID
STL023340
SMILES N#C/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)/C(=O)NN1CCN(CC1)C

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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 C25H27N5O3S MW 477.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O3S/c1-28-12-14-29(15-13-28)27-23(31)21(17-26)25-30(19-6-4-3-5-7-19)24(32)22(34-25)16-18-8-10-20(33-2)11-9-18/h3-11,22H,12-16H2,1-2H3,(H,27,31)/b25-21+
InChIKey
FYJXRORRTKXRCR-NJNXFGOHSA-N
Synonyms

(2E)2cyano2(5((4methoxyphenyl)methyl)4oxo3phenyl13thiazolidin2ylidene)N(4methylpiperazin1yl)acetamide
(2E)2cyano2(5(4methoxybenzyl)4oxo3phenyl13thiazolidin2ylidene)N(4methylpiperazin1yl)ethanamide
2CYANO2(5((4METHOXYPHENYL)METHYL)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))N(4METHYLPIPERAZINYL)ACETAMIDE
CN1CCN(CC1)NC(=O)C(=C2N(C(=O)C(S2)CC3=CC=C(C=C3)OC)C4=CC=CC=C4)C#N
InChI=1SC25H27N5O3Sc128121429(151328)2723(31)21(1726)2530(196435719)24(32)22(3425)161881020(332)11918h31122H1216H212H3(H2731)b2521+
MFCD09760301
N#CC(=C1SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)C(=O)NN1CCN(CC1)C
ZINC000054095983
ZINC000054095984

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Available files

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