Vitas-M small molecule compound
8-(2-chloro-6-fluorophenyl)-6-oxo-3-[3-(trifluoromethyl)phenyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827355
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1c(F)cccc1Cl)c1cccc(c1)C(F)(F)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 C21H14ClF4N3OS MW 467.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClF4N3OS/c22-16-5-2-6-17(23)19(16)14-8-18(30)29-10-28(11-31-20(29)15(14)9-27)13-4-1-3-12(7-13)21(24,25)26/h1-7,14H,8,10-11H2InChIKey
OPLHPBSPKBGRCB-UHFFFAOYSA-NSynonyms
8(2chloro6fluorophenyl)6oxo3(3(trifluoromethyl)phenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(2chloro6fluorophenyl)6oxo3(3(trifluoromethyl)phenyl)3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
C1C(C(=C2N(C1=O)CN(CS2)C3=CC=CC(=C3)C(F)(F)F)C#N)C4=C(C=CC=C4Cl)F
InChI=1SC21H14ClF4N3OSc221652617(23)19(16)14818(30)291028(113120(29)15(14)927)1341312(713)21(2425)26h1714H81011H2
MFCD10087675
ZINC000012251046
ZINC000012251047
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