Vitas-M small molecule compound

methyl 4-{(E)-2-cyano-2-[4-phenyl-5-(propanoylamino)-1,3-thiazol-2-yl]ethenyl}benzoate

Catalog ID
STK811154
SMILES CCC(=O)Nc1sc(nc1c1ccccc1)/C(=C/c1ccc(cc1)C(=O)OC)/C#N

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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 C23H19N3O3S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O3S/c1-3-19(27)25-22-20(16-7-5-4-6-8-16)26-21(30-22)18(14-24)13-15-9-11-17(12-10-15)23(28)29-2/h4-13H,3H2,1-2H3,(H,25,27)/b18-13+
InChIKey
XNAKTBMTZAHLIJ-QGOAFFKASA-N
Synonyms
608120-23-6
(E)methyl4(2cyano2(4phenyl5propionamidothiazol2yl)vinyl)benzoate
608120236
CCC(=O)NC1=C(N=C(S1)C(=CC2=CC=C(C=C2)C(=O)OC)C#N)C3=CC=CC=C3
CCC(=O)Nc1sc(nc1c1ccccc1)C(=Cc1ccc(cc1)C(=O)OC)C#N
InChI=1SC23H19N3O3Sc1319(27)252220(167546816)2621(3022)18(1424)131591117(121015)23(28)292h413H3H212H3(H2527)b1813+
methyl4((E)2cyano2(4phenyl5(propanoylamino)13thiazol2yl)ethenyl)benzoate
MFCD03665081
ZINC000004833960
ZINC04833960
ZINC4833960

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Available files

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