Vitas-M small molecule compound
3-(4-chlorophenyl)-6-oxo-8-(3,4,5-trimethoxyphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886080
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cc(OC)c(c(c1)OC)OC)c1ccc(cc1)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 C23H22ClN3O4S MW 471.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O4S/c1-29-19-8-14(9-20(30-2)22(19)31-3)17-10-21(28)27-12-26(13-32-23(27)18(17)11-25)16-6-4-15(24)5-7-16/h4-9,17H,10,12-13H2,1-3H3InChIKey
NSMSJBFYCDSCLF-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)6oxo8(345trimethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(4chlorophenyl)6oxo8(345trimethoxyphenyl)3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
COC1=CC(=CC(=C1OC)OC)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=C(C=C4)Cl
InChI=1SC23H22ClN3O4Sc12919814(920(302)22(19)313)171021(28)271226(133223(27)18(17)1125)166415(24)5716h4917H101213H213H3
MFCD14762425
ZINC000009693369
ZINC000009693370
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