Vitas-M small molecule compound

N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide

Catalog ID
STK401535
SMILES CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)C12CC3CC(C2)CC(C1)C3)(C)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 C25H34N2OS MW 410.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N2OS/c1-4-24(2,3)18-5-6-19-20(14-26)22(29-21(19)10-18)27-23(28)25-11-15-7-16(12-25)9-17(8-15)13-25/h15-18H,4-13H2,1-3H3,(H,27,28)
InChIKey
OVVAPQRPOPJFOE-UHFFFAOYSA-N
Synonyms
354544-07-3
354544073
CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C34CC5CC(C3)CC(C5)C4
InChI=1SC25H34N2OSc1424(23)18561920(1426)22(2921(19)1018)2723(28)251115716(1225)917(815)1325h1518H413H213H3(H2728)
MFCD01835583
N(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)adamantane1carboxamide
N(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)tricyclo(3311~37~)decane1carboxamide
ZINC000004646550
ZINC000004646551

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Available files

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