Vitas-M small molecule compound
3-hydroxy-5-(7-methoxy-1,3-benzodioxol-5-yl)-1-(pyridin-4-ylmethyl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STL434537
SMILES COc1cc(cc2c1OCO2)C1C(=C(C(=O)N1Cc1ccncc1)O)C(=O)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 C23H18N2O6S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O6S/c1-29-15-9-14(10-16-22(15)31-12-30-16)19-18(20(26)17-3-2-8-32-17)21(27)23(28)25(19)11-13-4-6-24-7-5-13/h2-10,19,27H,11-12H2,1H3InChIKey
VNIKNCHCIQRNDM-UHFFFAOYSA-NSynonyms
3hydroxy5(7methoxy13benzodioxol5yl)1(pyridin4ylmethyl)4(thiophen2ylcarbonyl)15dihydro2Hpyrrol2one
4hydroxy2(7methoxy13benzodioxol5yl)1(pyridin4ylmethyl)3(thiophene2carbonyl)2Hpyrrol5one
COC1=CC(=CC2=C1OCO2)C3C(=C(C(=O)N3CC4=CC=NC=C4)O)C(=O)C5=CC=CS5
InChI=1SC23H18N2O6Sc12915914(101622(15)31123016)1918(20(26)173283217)21(27)23(28)25(19)111346247513h2101927H1112H21H3
MFCD30711189
ZINC000096335806
ZINC000096335807
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