Vitas-M small molecule compound
3-(3-chloro-2-methylphenyl)-8-(2,6-dichlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827371
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1c(Cl)cccc1Cl)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 C21H16Cl3N3OS MW 464.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl3N3OS/c1-12-15(22)4-3-7-18(12)26-10-27-19(28)8-13(14(9-25)21(27)29-11-26)20-16(23)5-2-6-17(20)24/h2-7,13H,8,10-11H2,1H3InChIKey
PYMRRUAIOQUMRJ-UHFFFAOYSA-NSynonyms
3(3chloro2methylphenyl)8(26dichlorophenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chloro2methylphenyl)8(26dichlorophenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=CC=C1Cl)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=C(C=CC=C4Cl)Cl
InChI=1SC21H16Cl3N3OSc11215(22)43718(12)26102719(28)813(14(925)21(27)291126)2016(23)52617(20)24h2713H81011H21H3
MFCD10087700
ZINC000012251062
ZINC000012251063
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