Vitas-M small molecule compound
ethyl 6-tert-butyl-2-(dodecanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK448515
SMILES CCCCCCCCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CCC(C2)C(C)(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 C27H45NO3S MW 463.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H45NO3S/c1-6-8-9-10-11-12-13-14-15-16-23(29)28-25-24(26(30)31-7-2)21-18-17-20(27(3,4)5)19-22(21)32-25/h20H,6-19H2,1-5H3,(H,28,29)InChIKey
FZUNNTVQRVYKGW-UHFFFAOYSA-NSynonyms
CCCCCCCCCCCC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)OCC
ethyl6tertbutyl2(dodecanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC27H45NO3Sc16891011121314151623(29)282524(26(30)3172)21181720(27(34)5)1922(21)3225h20H619H215H3(H2829)
MFCD01358319
ZINC000097944990
ZINC000097944991
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