Vitas-M small molecule compound
methyl 2-[2-(2-methylphenyl)-4,6-dioxo-3-(thiophen-2-yl)hexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL020364
SMILES COC(=O)c1c(sc2c1CCCC2)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1C)c1cccs1
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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 C26H24N2O5S2 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5S2/c1-14-8-3-5-10-16(14)28-21(18-12-7-13-34-18)20-22(33-28)24(30)27(23(20)29)25-19(26(31)32-2)15-9-4-6-11-17(15)35-25/h3,5,7-8,10,12-13,20-22H,4,6,9,11H2,1-2H3InChIKey
WSKABRHZVHHUGL-UHFFFAOYSA-NSynonyms
1005093-97-91005093979
CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=C(C5=C(S4)CCCC5)C(=O)OC)C6=CC=CS6
InChI=1SC26H24N2O5S2c1148351016(14)2821(18127133418)2022(3328)24(30)27(23(20)29)2519(26(31)322)159461117(15)3525h35781012132022H46911H212H3
methyl2(2(2methylphenyl)46dioxo3(thiophen2yl)hexahydro5Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carboxylate
methyl2(2(2methylphenyl)46dioxo3thiophen2yl3a6adihydro3Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carboxylate
MFCD02971218
ZINC000008741691
ZINC000229969031
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