Vitas-M small molecule compound
8-{4-[(2-chlorobenzyl)oxy]phenyl}-3-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887005
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccccc1Cl)c1ccc(cc1)OC
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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 C28H24ClN3O3S MW 518.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN3O3S/c1-34-22-12-8-21(9-13-22)31-17-32-27(33)14-24(25(15-30)28(32)36-18-31)19-6-10-23(11-7-19)35-16-20-4-2-3-5-26(20)29/h2-13,24H,14,16-18H2,1H3InChIKey
JEMHQTCEKFDQBJ-UHFFFAOYSA-NSynonyms
8(4((2chlorobenzyl)oxy)phenyl)3(4methoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
8(4((2chlorophenyl)methoxy)phenyl)3(4methoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
COC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5Cl
InChI=1SC28H24ClN3O3Sc1342212821(91322)31173227(33)1424(25(1530)28(32)361831)1961023(11719)351620423526(20)29h21324H141618H21H3
MFCD10087728
ZINC000012251082
ZINC000012251083
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