Vitas-M small molecule compound
3-(3-chloro-2-methylphenyl)-8-(2-methoxynaphthalen-1-yl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886940
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1c(OC)ccc2c1cccc2)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 C26H22ClN3O2S MW 476.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O2S/c1-16-21(27)8-5-9-22(16)29-14-30-24(31)12-19(20(13-28)26(30)33-15-29)25-18-7-4-3-6-17(18)10-11-23(25)32-2/h3-11,19H,12,14-15H2,1-2H3InChIKey
ATBWTYKUAFYQMV-UHFFFAOYSA-NSynonyms
3(3chloro2methylphenyl)8(2methoxynaphthalen1yl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chloro2methylphenyl)8(2methoxynaphthalen1yl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=CC=C1Cl)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=C(C=CC5=CC=CC=C54)OC
InChI=1SC26H22ClN3O2Sc11621(27)85922(16)29143024(31)1219(20(1328)26(30)331529)2518743617(18)101123(25)322h31119H121415H212H3
MFCD10087614
ZINC000012250998
ZINC000012250999
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