Vitas-M small molecule compound
3-(3-chloro-2-methylphenyl)-8-(4-chlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887103
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)Cl)c1cccc(c1C)Cl
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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 C21H17Cl2N3OS MW 430.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3OS/c1-13-18(23)3-2-4-19(13)25-11-26-20(27)9-16(14-5-7-15(22)8-6-14)17(10-24)21(26)28-12-25/h2-8,16H,9,11-12H2,1H3InChIKey
KRPJWEVQKKIKNO-UHFFFAOYSA-NSynonyms
3(3chloro2methylphenyl)8(4chlorophenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chloro2methylphenyl)8(4chlorophenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=CC=C1Cl)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)Cl
InChI=1SC21H17Cl2N3OSc11318(23)32419(13)25112620(27)916(145715(22)8614)17(1024)21(26)281225h2816H91112H21H3
MFCD10087879
ZINC000009693120
ZINC000009693221
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