Vitas-M small molecule compound

methyl 3-amino-2-cyano-6-methyl-4-(3,4,5-trimethoxyphenyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

Catalog ID
STK787178
SMILES COC(=O)C1=C(C)Nc2c(C1c1cc(OC)c(c(c1)OC)OC)c(N)c(s2)C#N

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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 C20H21N3O5S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S/c1-9-14(20(24)28-5)15(16-17(22)13(8-21)29-19(16)23-9)10-6-11(25-2)18(27-4)12(7-10)26-3/h6-7,15,23H,22H2,1-5H3
InChIKey
VNUDVWLDSCKNNI-UHFFFAOYSA-N
Synonyms
920482-13-9
920482139
CC1=C(C(C2=C(N1)SC(=C2N)C#N)C3=CC(=C(C(=C3)OC)OC)OC)C(=O)OC
InChI=1SC20H21N3O5Sc1914(20(24)285)15(1617(22)13(821)2919(16)239)10611(252)18(274)12(710)263h671523H22H215H3
methyl3amino2cyano6methyl4(345trimethoxyphenyl)47dihydrothieno(23b)pyridine5carboxylate
MFCD08560347
ZINC000013624507
ZINC000013624509

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Available files

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