Vitas-M small molecule compound
methyl 2-{[(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]hept-1-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK851212
SMILES COC(=O)c1c(sc2c1CCCC2)NC(=O)C12CCC(C2(C)C)(C(=O)O1)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 C20H25NO5S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO5S/c1-18(2)19(3)9-10-20(18,26-17(19)24)16(23)21-14-13(15(22)25-4)11-7-5-6-8-12(11)27-14/h5-10H2,1-4H3,(H,21,23)InChIKey
ZDYDPUNTOSEJKN-UHFFFAOYSA-NSynonyms
618401-61-9618401619
CC1(C2(CCC1(OC2=O)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC)C)C
InChI=1SC20H25NO5Sc118(2)19(3)91020(182617(19)24)16(23)211413(15(22)254)11756812(11)2714h510H214H3(H2123)
methyl2(((477trimethyl3oxo2oxabicyclo(221)hept1yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((177trimethyl2oxo3oxabicyclo(221)heptane4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((1S4S)477trimethyl3oxo2oxabicyclo(221)heptane1carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD06278068
ZINC000004810826
Check stock
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