Vitas-M small molecule compound

8-(5-bromo-2-methoxyphenyl)-3-(furan-2-ylmethyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile

Catalog ID
STK852452
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cc(Br)ccc1OC)Cc1ccco1

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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 C20H18BrN3O3S MW 460.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O3S/c1-26-18-5-4-13(21)7-16(18)15-8-19(25)24-11-23(10-14-3-2-6-27-14)12-28-20(24)17(15)9-22/h2-7,15H,8,10-12H2,1H3
InChIKey
BPMODHSCCKFRQD-UHFFFAOYSA-N
Synonyms
896089-59-1
8(5bromo2methoxyphenyl)3(furan2ylmethyl)6oxo234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(furan2ylmethyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(furan2ylmethyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896089591
COC1=C(C=C(C=C1)Br)C2CC(=O)N3CN(CSC3=C2C#N)CC4=CC=CO4
InChI=1SC20H18BrN3O3Sc126185413(21)716(18)15819(25)241123(10143262714)122820(24)17(15)922h2715H81012H21H3
MFCD06605810
ZINC000020348379
ZINC000020348381

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Available files

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