Vitas-M small molecule compound
1-(2,4-dimethoxyphenyl)-5-hydroxy-7-(thiophen-3-yl)-6,7-dihydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Catalog ID
STK935270
SMILES COc1cc(OC)ccc1n1cc(c2c1C(CC(=N2)O)c1cscc1)C(=O)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 C20H18N2O5S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S/c1-26-12-3-4-15(16(7-12)27-2)22-9-14(20(24)25)18-19(22)13(8-17(23)21-18)11-5-6-28-10-11/h3-7,9-10,13H,8H2,1-2H3,(H,21,23)(H,24,25)InChIKey
KCAFLEZRSXSWSE-UHFFFAOYSA-NSynonyms
1224169-02-11(24dimethoxyphenyl)5hydroxy7(thiophen3yl)67dihydro1Hpyrrolo(32b)pyridine3carboxylicacid
1(24dimethoxyphenyl)5oxo7thiophen3yl67dihydro4Hpyrrolo(32b)pyridine3carboxylicacid
1224169021
COC1=CC(=C(C=C1)N2C=C(C3=C2C(CC(=O)N3)C4=CSC=C4)C(=O)O)OC
InChI=1SC20H18N2O5Sc126123415(16(712)272)22914(20(24)25)1819(22)13(817(23)2118)1156281011h3791013H8H212H3(H2123)(H2425)
MFCD18178014
ZINC000044901143
ZINC000044901145
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