Vitas-M small molecule compound
butyl 3,6-diamino-5-cyano-4-(3,4-dimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate
Catalog ID
STK838912
SMILES CCCCOC(=O)c1sc2c(c1N)c(c1ccc(c(c1)OC)OC)c(c(n2)N)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 C21H22N4O4S MW 426.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4S/c1-4-5-8-29-21(26)18-17(23)16-15(12(10-22)19(24)25-20(16)30-18)11-6-7-13(27-2)14(9-11)28-3/h6-7,9H,4-5,8,23H2,1-3H3,(H2,24,25)InChIKey
OMIFREFKSCRPOM-UHFFFAOYSA-NSynonyms
BUTYL36DIAMINO4(34DIMETHOXYPHENYL)5CYANOTHIOPHENO(23B)PYRIDINE2CARBOXYLATE
butyl36diamino5cyano4(34dimethoxyphenyl)thieno(23b)pyridine2carboxylate
CCCCOC(=O)C1=C(C2=C(S1)N=C(C(=C2C3=CC(=C(C=C3)OC)OC)C#N)N)N
InChI=1SC21H22N4O4Sc14582921(26)1817(23)1615(12(1022)19(24)2520(16)3018)116713(272)14(911)283h679H45823H213H3(H22425)
MFCD02106914
ZINC000019904873
ZINC19904873
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