Vitas-M small molecule compound
8-(2-chloro-6-fluorophenyl)-3-(2-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887177
SMILES CCOc1ccccc1N1CSC2=C(C#N)C(CC(=O)N2C1)c1c(F)cccc1Cl
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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 C22H19ClFN3O2S MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClFN3O2S/c1-2-29-19-9-4-3-8-18(19)26-12-27-20(28)10-14(15(11-25)22(27)30-13-26)21-16(23)6-5-7-17(21)24/h3-9,14H,2,10,12-13H2,1H3InChIKey
DTJDVCGKPPPSNH-UHFFFAOYSA-NSynonyms
8(2chloro6fluorophenyl)3(2ethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(2chloro6fluorophenyl)3(2ethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCOC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=C(C=CC=C4Cl)F
InChI=1SC22H19ClFN3O2Sc122919943818(19)26122720(28)1014(15(1125)22(27)301326)2116(23)65717(21)24h3914H2101213H21H3
MFCD10087998
ZINC000009693319
ZINC000009693320
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