Vitas-M small molecule compound
methyl 2-(4,6-dioxo-2,3-diphenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL020301
SMILES COC(=O)c1c(sc2c1CCCC2)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)c1ccccc1
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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 C27H24N2O5S MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O5S/c1-33-27(32)20-18-14-8-9-15-19(18)35-26(20)28-24(30)21-22(16-10-4-2-5-11-16)29(34-23(21)25(28)31)17-12-6-3-7-13-17/h2-7,10-13,21-23H,8-9,14-15H2,1H3InChIKey
OFXKPXNHFCOXLP-UHFFFAOYSA-NSynonyms
1005060-85-41005060854
COC(=O)C1=C(SC2=C1CCCC2)N3C(=O)C4C(N(OC4C3=O)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC27H24N2O5Sc13327(32)201814891519(18)3526(20)2824(30)2122(16104251116)29(3423(21)25(28)31)17126371317h2710132123H891415H21H3
methyl2(46dioxo23diphenyl3a6adihydro3Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carboxylate
methyl2(46dioxo23diphenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carboxylate
MFCD02970672
ZINC000102219133
ZINC000239377952
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