Vitas-M small molecule compound
ethyl 6-tert-butyl-2-(hexanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK432024
SMILES CCCCCC(=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 C21H33NO3S MW 379.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33NO3S/c1-6-8-9-10-17(23)22-19-18(20(24)25-7-2)15-12-11-14(21(3,4)5)13-16(15)26-19/h14H,6-13H2,1-5H3,(H,22,23)InChIKey
JVMWOJHOMDSMNC-UHFFFAOYSA-NSynonyms
CCCCCC(=O)NC1=C(C2=C(S1)CC(CC2)C(C)(C)C)C(=O)OCC
ethyl6tertbutyl2(hexanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H33NO3Sc16891017(23)221918(20(24)2572)15121114(21(34)5)1316(15)2619h14H613H215H3(H2223)
MFCD01352079
ZINC000002741448
ZINC000002741449
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