Vitas-M small molecule compound
ethyl [9-cyano-8-(4-fluorophenyl)-6-oxo-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl]acetate
Catalog ID
STK886460
SMILES CCOC(=O)CN1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(cc1)F
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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 C18H18FN3O3S MW 375.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FN3O3S/c1-2-25-17(24)9-21-10-22-16(23)7-14(12-3-5-13(19)6-4-12)15(8-20)18(22)26-11-21/h3-6,14H,2,7,9-11H2,1H3InChIKey
RVRWICSFJMIZPD-UHFFFAOYSA-NSynonyms
CCOC(=O)CN1CN2C(=O)CC(C(=C2SC1)C#N)C3=CC=C(C=C3)F
ethyl(9cyano8(4fluorophenyl)6oxo78dihydro2H6Hpyrido(21b)(135)thiadiazin3(4H)yl)acetate
ethyl2(9cyano8(4fluorophenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazin3yl)acetate
InChI=1SC18H18FN3O3Sc122517(24)921102216(23)714(123513(19)6412)15(820)18(22)261121h3614H27911H21H3
MFCD10086920
ZINC000020348001
ZINC000020348002
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