Vitas-M small molecule compound
3-benzyl-8-[3-(benzyloxy)phenyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886961
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cccc(c1)OCc1ccccc1)Cc1ccccc1
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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 C28H25N3O2S MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O2S/c29-16-26-25(23-12-7-13-24(14-23)33-18-22-10-5-2-6-11-22)15-27(32)31-19-30(20-34-28(26)31)17-21-8-3-1-4-9-21/h1-14,25H,15,17-20H2InChIKey
WOTQZWUUZCDGDX-UHFFFAOYSA-NSynonyms
3benzyl6oxo8(3phenylmethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3benzyl8(3(benzyloxy)phenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
C1C(C(=C2N(C1=O)CN(CS2)CC3=CC=CC=C3)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC28H25N3O2Sc29162625(231271324(1423)331822105261122)1527(32)311930(203428(26)31)17218314921h11425H151720H2
MFCD10087650
ZINC000020238348
ZINC000020238351
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