Vitas-M small molecule compound
ethyl (2Z)-5-amino-8-cyano-7-(furan-2-yl)-2-(furan-2-ylmethylidene)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate
Catalog ID
STK754929
SMILES CCOC(=O)C1=C(N)n2c(=C(C1c1ccco1)C#N)s/c(=C\c1ccco1)/c2=O
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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 C20H15N3O5S MW 409.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O5S/c1-2-26-20(25)16-15(13-6-4-8-28-13)12(10-21)19-23(17(16)22)18(24)14(29-19)9-11-5-3-7-27-11/h3-9,15H,2,22H2,1H3/b14-9-InChIKey
NDWRTKZCESUJBG-ZROIWOOFSA-NSynonyms
CCOC(=O)C1=C(N)n2c(=C(C1c1ccco1)C#N)sc(=Cc1ccco1)c2=O
CCOC(=O)C1=C(N2C(=C(C1C3=CC=CO3)C#N)SC(=CC4=CC=CO4)C2=O)N
ethyl(2Z)5amino8cyano7(furan2yl)2(furan2ylmethylidene)3oxo23dihydro7H(13)thiazolo(32a)pyridine6carboxylate
ETHYL(2Z)5AMINO8CYANO7(FURAN2YL)2(FURAN2YLMETHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE6CARBOXYLATE
InChI=1SC20H15N3O5Sc122620(25)1615(136482813)12(1021)1923(17(16)22)18(24)14(2919)9115372711h3915H222H21H3b149
MFCD00826989
ZINC000002187476
ZINC000002187478
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