Vitas-M small molecule compound
ethyl 2-[(2-ethylhexanoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK448688
SMILES CCCCC(C(=O)Nc1sc2c(c1C(=O)OCC)CCCCCC2)CC
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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/c1-4-7-12-15(5-2)19(23)22-20-18(21(24)25-6-3)16-13-10-8-9-11-14-17(16)26-20/h15H,4-14H2,1-3H3,(H,22,23)InChIKey
NMDRGQXRJFBXFE-UHFFFAOYSA-NSynonyms
CCCCC(CC)C(=O)NC1=C(C2=C(S1)CCCCCC2)C(=O)OCC
ethyl2((2ethylhexanoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2(2ethylhexanoylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC21H33NO3Sc1471215(52)19(23)222018(21(24)2563)16131089111417(16)2620h15H414H213H3(H2223)
MFCD01920043
ZINC000005793049
ZINC000005793161
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