Vitas-M small molecule compound
8-(5-bromo-2-methoxyphenyl)-3-(4-ethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887171
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cc(Br)ccc1OC)c1ccc(cc1)CC
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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 C23H22BrN3O2S MW 484.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O2S/c1-3-15-4-7-17(8-5-15)26-13-27-22(28)11-18(20(12-25)23(27)30-14-26)19-10-16(24)6-9-21(19)29-2/h4-10,18H,3,11,13-14H2,1-2H3InChIKey
CQFYETPTJKSFGC-UHFFFAOYSA-NSynonyms
8(5bromo2methoxyphenyl)3(4ethylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(4ethylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=C(C=CC(=C4)Br)OC
InChI=1SC23H22BrN3O2Sc13154717(8515)26132722(28)1118(20(1225)23(27)301426)191016(24)6921(19)292h41018H3111314H212H3
MFCD10087988
ZINC000009693455
ZINC000009693456
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