Vitas-M small molecule compound

methyl 5-amino-7-(4-bromothiophen-2-yl)-6-cyano-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate

Catalog ID
STK778191
SMILES COC(=O)c1c(C)sc2c1OC(=C(C2c1scc(c1)Br)C#N)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 C15H11BrN2O3S2 MW 411.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN2O3S2/c1-6-10(15(19)20-2)12-13(23-6)11(8(4-17)14(18)21-12)9-3-7(16)5-22-9/h3,5,11H,18H2,1-2H3
InChIKey
KRJCCTZGOZLVHM-UHFFFAOYSA-N
Synonyms

CC1=C(C2=C(S1)C(C(=C(O2)N)C#N)C3=CC(=CS3)Br)C(=O)OC
InChI=1SC15H11BrN2O3S2c1610(15(19)202)1213(236)11(8(417)14(18)2112)937(16)5229h3511H18H212H3
methyl5amino7(4bromothiophen2yl)6cyano2methyl7Hthieno(32b)pyran3carboxylate
MFCD05855904
ZINC000001426971
ZINC000001426972

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Available files

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