Vitas-M small molecule compound
5'-hydroxy-3'-(4-methoxyphenyl)-1-methyl-2-oxo-5-(propan-2-yl)-1,2-dihydro-6'H-spiro[indole-3,7'-thieno[3,2-b]pyridine]-2'-carboxylic acid
Catalog ID
STK652583
SMILES COc1ccc(cc1)c1c2N=C(O)CC3(c2sc1C(=O)O)c1cc(ccc1N(C3=O)C)C(C)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 C26H24N2O5S MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O5S/c1-13(2)15-7-10-18-17(11-15)26(25(32)28(18)3)12-19(29)27-21-20(22(24(30)31)34-23(21)26)14-5-8-16(33-4)9-6-14/h5-11,13H,12H2,1-4H3,(H,27,29)(H,30,31)InChIKey
UMBHGIOCPSECHG-UHFFFAOYSA-NSynonyms
1190260-19-51190260195
3(4methoxyphenyl)1methyl25dioxo5propan2ylspiro(46dihydrothieno(32b)pyridine73indole)2carboxylicacid
5hydroxy3(4methoxyphenyl)1methyl2oxo5(propan2yl)12dihydro6Hspiro(indole37thieno(32b)pyridine)2carboxylicacid
CC(C)C1=CC2=C(C=C1)N(C(=O)C23CC(=O)NC4=C3SC(=C4C5=CC=C(C=C5)OC)C(=O)O)C
InChI=1SC26H24N2O5Sc113(2)157101817(1115)26(25(32)28(18)3)1219(29)272120(22(24(30)31)3423(21)26)145816(334)9614h51113H12H214H3(H2729)(H3031)
MFCD18166382
ZINC000036353298
ZINC000036353300
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