Vitas-M small molecule compound

N-(2,5-dimethoxyphenyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide

Catalog ID
STL539050
SMILES COc1ccc(cc1NC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2)OC

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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 C18H25N3O4S MW 379.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O4S/c1-24-11-7-8-14(25-2)12(9-11)19-16(22)6-4-3-5-15-17-13(10-26-15)20-18(23)21-17/h7-9,13,15,17H,3-6,10H2,1-2H3,(H,19,22)(H2,20,21,23)/t13-,15-,17-/m0/s1
InChIKey
OTKXQVAKISGUSV-QRTARXTBSA-N
Synonyms
1808725-81-6
1808725816
34366842
5((3~(a)~(S)4~(S)6~(a)~(R))2oxo133~(a)466~(a)hexahydrothieno(34d)imidazol4yl)~(N)(25dimethoxyphenyl)pentanamide
5((3AS4S6AR)2OXOHEXAHYDRO1HTHIENO(34D)IMIDAZOLIDIN4YL)N(25DIMETHOXYPHENYL)PENTANAMIDE
COc1ccc(cc1NC(=O)CCCC(C@@H)1SC(C@H)2(C@@H)1NC(=O)N2)OC
InChI=1SC18H25N3O4Sc124117814(252)12(911)1916(22)6435151713(102615)2018(23)2117h79131517H3610H212H3(H1922)(H2202123)t131517m0s1
N(25dimethoxyphenyl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
ZINC000027065520

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.