Vitas-M small molecule compound
8-{4-[(2-chlorobenzyl)oxy]phenyl}-3-(3-chloro-4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887004
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccccc1Cl)c1ccc(c(c1)Cl)C
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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 C28H23Cl2N3O2S MW 536.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23Cl2N3O2S/c1-18-6-9-21(12-26(18)30)32-16-33-27(34)13-23(24(14-31)28(33)36-17-32)19-7-10-22(11-8-19)35-15-20-4-2-3-5-25(20)29/h2-12,23H,13,15-17H2,1H3InChIKey
XXSCLRYVORHMKF-UHFFFAOYSA-NSynonyms
3(3chloro4methylphenyl)8(4((2chlorophenyl)methoxy)phenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4((2chlorobenzyl)oxy)phenyl)3(3chloro4methylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5Cl)Cl
InChI=1SC28H23Cl2N3O2Sc1186921(1226(18)30)32163327(34)1323(24(1431)28(33)361732)1971022(11819)351520423525(20)29h21223H131517H21H3
MFCD10087727
ZINC000098048445
ZINC000098048446
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