Vitas-M small molecule compound
N-benzyl-4-[5-cyano-3,3-dimethyl-8-(2-methylpropyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]piperazine-1-carbothioamide
Catalog ID
STK524809
SMILES N#Cc1c(nc(c2c1CC(C)(C)OC2)CC(C)C)N1CCN(CC1)C(=S)NCc1ccccc1
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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 C27H35N5OS MW 477.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N5OS/c1-19(2)14-24-23-18-33-27(3,4)15-21(23)22(16-28)25(30-24)31-10-12-32(13-11-31)26(34)29-17-20-8-6-5-7-9-20/h5-9,19H,10-15,17-18H2,1-4H3,(H,29,34)InChIKey
ROIWYDFOYGJBIX-UHFFFAOYSA-NSynonyms
328068593
CC(C)CC1=C2COC(CC2=C(C(=N1)N3CCN(CC3)C(=S)NCC4=CC=CC=C4)C#N)(C)C
InChI=1SC27H35N5OSc119(2)142423183327(34)1521(23)22(1628)25(3024)31101232(131131)26(34)2917208657920h5919H10151718H214H3(H2934)
MFCD01557922
NBENZYL4(5CYANO33DIMETHYL8(2METHYLPROPYL)14DIHYDROPYRANO(34C)PYRIDIN6YL)PIPERAZINE1CARBOTHIOAMIDE
Nbenzyl4(5cyano33dimethyl8(2methylpropyl)34dihydro1Hpyrano(34c)pyridin6yl)piperazine1carbothioamide
Nbenzyl4(5cyano8isobutyl33dimethyl34dihydro1Hpyrano(34c)pyridin6yl)piperazine1carbothioamide
ZINC000020814152
ZINC20814152
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