Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-5-(7-methoxy-1,3-benzodioxol-5-yl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STL434538
SMILES COc1cc(cc2c1OCO2)C1N(Cc2ccc3c(c2)OCO3)C(=O)C(=C1C(=O)c1cccs1)O
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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 C25H19NO8S MW 493.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO8S/c1-30-17-8-14(9-18-24(17)34-12-33-18)21-20(22(27)19-3-2-6-35-19)23(28)25(29)26(21)10-13-4-5-15-16(7-13)32-11-31-15/h2-9,21,28H,10-12H2,1H3InChIKey
BDLKJDALXOSBPE-UHFFFAOYSA-NSynonyms
1(13benzodioxol5ylmethyl)3hydroxy5(7methoxy13benzodioxol5yl)4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
1(13benzodioxol5ylmethyl)4hydroxy2(7methoxy13benzodioxol5yl)3(thiophene2carbonyl)2Hpyrrol5one
COC1=CC(=CC2=C1OCO2)C3C(=C(C(=O)N3CC4=CC5=C(C=C4)OCO5)O)C(=O)C6=CC=CS6
InChI=1SC25H19NO8Sc13017814(91824(17)34123318)2120(22(27)193263519)23(28)25(29)26(21)1013451516(713)32113115h292128H1012H21H3
MFCD30711190
ZINC000096335808
ZINC000096335809
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