Vitas-M small molecule compound
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanamide
Catalog ID
STK725443
SMILES CSCCC(N1C(=O)c2c(C1=O)cccc2)C(=O)Nc1sc2c(c1C#N)CCCCC2
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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 C23H23N3O3S2 MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S2/c1-30-12-11-18(26-22(28)15-8-5-6-9-16(15)23(26)29)20(27)25-21-17(13-24)14-7-3-2-4-10-19(14)31-21/h5-6,8-9,18H,2-4,7,10-12H2,1H3,(H,25,27)InChIKey
HCHGMYGLSQCNPW-UHFFFAOYSA-NSynonyms
CSCCC(C(=O)NC1=C(C2=C(S1)CCCCC2)C#N)N3C(=O)C4=CC=CC=C4C3=O
InChI=1SC23H23N3O3S2c130121118(2622(28)15856916(15)23(26)29)20(27)252117(1324)1473241019(14)3121h568918H2471012H21H3(H2527)
MFCD02990939
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(13dioxo13dihydro2Hisoindol2yl)4(methylsulfanyl)butanamide
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(13dioxoisoindol2yl)4methylsulfanylbutanamide
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(13dioxoisoindolin2yl)4(methylthio)butanamide
ZINC000001814077
ZINC000001814078
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