Vitas-M small molecule compound
3-cyclohexyl-8-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887111
SMILES CCOc1ccc(cc1)C1CC(=O)N2C(=C1C#N)SCN(C2)C1CCCCC1
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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 C22H27N3O2S MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2S/c1-2-27-18-10-8-16(9-11-18)19-12-21(26)25-14-24(17-6-4-3-5-7-17)15-28-22(25)20(19)13-23/h8-11,17,19H,2-7,12,14-15H2,1H3InChIKey
FVDKTSQPLUQKQF-UHFFFAOYSA-NSynonyms
3cyclohexyl8(4ethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3cyclohexyl8(4ethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCOC1=CC=C(C=C1)C2CC(=O)N3CN(CSC3=C2C#N)C4CCCCC4
InChI=1SC22H27N3O2Sc12271810816(91118)191221(26)251424(176435717)152822(25)20(19)1323h8111719H27121415H21H3
MFCD10087892
ZINC000020237990
ZINC000020237993
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