Vitas-M small molecule compound
8-(4-hydroxy-3-methoxyphenyl)-6-(4-methylphenyl)-3,4a,7a,8-tetrahydropyrrolo[3',4':5,6]thiopyrano[2,3-d][1,3]thiazole-2,5,7(6H)-trione
Catalog ID
STK554377
SMILES COc1cc(ccc1O)C1c2sc(=O)[nH]c2SC2C1C(=O)N(C2=O)c1ccc(cc1)C
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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 C22H18N2O5S2 MW 454.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O5S2/c1-10-3-6-12(7-4-10)24-20(26)16-15(11-5-8-13(25)14(9-11)29-2)17-19(23-22(28)31-17)30-18(16)21(24)27/h3-9,15-16,18,25H,1-2H3,(H,23,28)InChIKey
LQRXVRDYPFEJOP-UHFFFAOYSA-NSynonyms
1005072-32-11005072321
8(4hydroxy3methoxyphenyl)6(4methylphenyl)34a7a8tetrahydropyrrolo(23)thiopyrano(45b)(13)thiazole257trione
8(4hydroxy3methoxyphenyl)6(4methylphenyl)34a7a8tetrahydropyrrolo(3456)thiopyrano(23d)(13)thiazole257(6H)trione
8(4hydroxy3methoxyphenyl)6(ptolyl)7a8dihydropyrrolo(3456)thiopyrano(23d)thiazole257(3H4aH6H)trione
CC1=CC=C(C=C1)N2C(=O)C3C(C4=C(NC(=O)S4)SC3C2=O)C5=CC(=C(C=C5)O)OC
COc1cc(ccc1O)C1c2sc(=O)(nH)c2SC2C1C(=O)N(C2=O)c1ccc(cc1)C
InChI=1SC22H18N2O5S2c1103612(7410)2420(26)1615(115813(25)14(911)292)1719(2322(28)3117)3018(16)21(24)27h3915161825H12H3(H2328)
MFCD02980692
ZINC000013638987
ZINC000102723754
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