Vitas-M small molecule compound
ethyl 7-oxo-6-(phenylsulfanyl)-2-(propanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK280142
SMILES CCOC(=O)c1c(NC(=O)CC)sc2c1CCC(C2=O)Sc1ccccc1
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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 C20H21NO4S2 MW 403.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO4S2/c1-3-15(22)21-19-16(20(24)25-4-2)13-10-11-14(17(23)18(13)27-19)26-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3,(H,21,22)InChIKey
MYJPLTUPQWUJOI-UHFFFAOYSA-NSynonyms
CCC(=O)NC1=C(C2=C(S1)C(=O)C(CC2)SC3=CC=CC=C3)C(=O)OCC
ethyl7oxo6(phenylsulfanyl)2(propanoylamino)4567tetrahydro1benzothiophene3carboxylate
ETHYL7OXO6PHENYLSULFANYL2(PROPANOYLAMINO)56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE
ETHYL7OXO6PHENYLTHIO2(PROPANOYLAMINO)456TRIHYDROBENZO(B)THIOPHENE3CARBOXYLATE
InChI=1SC20H21NO4S2c1315(22)211916(20(24)2542)13101114(17(23)18(13)2719)26128657912h5914H341011H212H3(H2122)
MFCD00367254
ZINC000000846744
ZINC000000846745
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