Vitas-M small molecule compound

methyl 4-[3-(3,4-dimethoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridin-7-yl]benzoate

Catalog ID
STK693638
SMILES COC(=O)c1ccc(cc1)C1CC(=O)Nc2c1scc2c1ccc(c(c1)OC)OC

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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 C23H21NO5S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO5S/c1-27-18-9-8-15(10-19(18)28-2)17-12-30-22-16(11-20(25)24-21(17)22)13-4-6-14(7-5-13)23(26)29-3/h4-10,12,16H,11H2,1-3H3,(H,24,25)
InChIKey
LZYOUCIISOWJEO-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C2=CSC3=C2NC(=O)CC3C4=CC=C(C=C4)C(=O)OC)OC
InChI=1SC23H21NO5Sc127189815(1019(18)282)1712302216(1120(25)2421(17)22)134614(7513)23(26)293h4101216H11H213H3(H2425)
methyl4(3(34dimethoxyphenyl)5oxo4567tetrahydrothieno(32b)pyridin7yl)benzoate
methyl4(3(34dimethoxyphenyl)5oxo67dihydro4Hthieno(32b)pyridin7yl)benzoate
MFCD12033734
ZINC000015107648
ZINC000015107651

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.