Vitas-M small molecule compound
8-{4-[(4-chlorobenzyl)oxy]phenyl}-3-(3,4-dimethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887023
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccc(c(c1)C)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 C29H26ClN3O2S MW 516.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClN3O2S/c1-19-3-10-24(13-20(19)2)32-17-33-28(34)14-26(27(15-31)29(33)36-18-32)22-6-11-25(12-7-22)35-16-21-4-8-23(30)9-5-21/h3-13,26H,14,16-18H2,1-2H3InChIKey
KSFDZZHUJMEIHV-UHFFFAOYSA-NSynonyms
8(4((4chlorobenzyl)oxy)phenyl)3(34dimethylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
8(4((4chlorophenyl)methoxy)phenyl)3(34dimethylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)OCC5=CC=C(C=C5)Cl)C
InChI=1SC29H26ClN3O2Sc11931024(1320(19)2)32173328(34)1426(27(1531)29(33)361832)2261125(12722)3516214823(30)9521h31326H141618H212H3
MFCD10087760
ZINC000012251108
ZINC000012251109
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