Vitas-M small molecule compound

4-[5-cyano-3,3-dimethyl-8-(2-methylpropyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]-N-phenylpiperazine-1-carbothioamide

Catalog ID
STK721172
SMILES N#Cc1c(nc(c2c1CC(C)(C)OC2)CC(C)C)N1CCN(CC1)C(=S)Nc1ccccc1

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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 C26H33N5OS MW 463.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N5OS/c1-18(2)14-23-22-17-32-26(3,4)15-20(22)21(16-27)24(29-23)30-10-12-31(13-11-30)25(33)28-19-8-6-5-7-9-19/h5-9,18H,10-15,17H2,1-4H3,(H,28,33)
InChIKey
PXGHHKRXYPZQAN-UHFFFAOYSA-N
Synonyms
368888-79-3
33DIMETHYL8(2METHYLPROPYL)6(4((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)34DIHYDRO1HPYRANO(34C)PYRIDINE5CARBONITRILE
368888793
4(5CYANO33DIMETHYL8(2METHYLPROPYL)14DIHYDROPYRANO(34C)PYRIDIN6YL)NPHENYLPIPERAZINE1CARBOTHIOAMIDE
4(5cyano33dimethyl8(2methylpropyl)34dihydro1Hpyrano(34c)pyridin6yl)Nphenylpiperazine1carbothioamide
4(5cyano8isobutyl33dimethyl34dihydro1Hpyrano(34c)pyridin6yl)Nphenylpiperazine1carbothioamide
CC(C)CC1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NC4=CC=CC=C4)C#N)(C)C
InChI=1SC26H33N5OSc118(2)142322173226(34)1520(22)21(1627)24(2923)30101231(131130)25(33)28198657919h5918H101517H214H3(H2833)
MFCD01557601
ZINC000019418285
ZINC19418285

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Available files

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