Vitas-M small molecule compound
methyl 5-amino-6-cyano-2-methyl-7-(3-methyl-1-benzothiophen-2-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
Catalog ID
STK783111
SMILES N#CC1=C(N)Oc2c(C1c1sc3c(c1C)cccc3)sc(c2C(=O)OC)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 C20H16N2O3S2 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O3S2/c1-9-11-6-4-5-7-13(11)27-17(9)15-12(8-21)19(22)25-16-14(20(23)24-3)10(2)26-18(15)16/h4-7,15H,22H2,1-3H3InChIKey
WRRVKQJEAXTONL-UHFFFAOYSA-NSynonyms
CC1=C(SC2=CC=CC=C12)C3C(=C(OC4=C3SC(=C4C(=O)OC)C)N)C#N
InChI=1SC20H16N2O3S2c1911645713(11)2717(9)1512(821)19(22)251614(20(23)243)10(2)2618(15)16h4715H22H213H3
methyl5amino6cyano2methyl7(3methyl1benzothiophen2yl)7Hthieno(32b)pyran3carboxylate
MFCD06617535
ZINC000004744896
ZINC000004744898
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