Vitas-M small molecule compound

7-tert-butyl-4-(4-hydroxyphenyl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one

Catalog ID
STK693333
SMILES O=C1Nc2sc3c(c2C(C1)c1ccc(cc1)O)CCC(C3)C(C)(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 C21H25NO2S MW 355.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO2S/c1-21(2,3)13-6-9-15-17(10-13)25-20-19(15)16(11-18(24)22-20)12-4-7-14(23)8-5-12/h4-5,7-8,13,16,23H,6,9-11H2,1-3H3,(H,22,24)
InChIKey
HJLKMEAWGDEDRM-UHFFFAOYSA-N
Synonyms

7tertbutyl4(4hydroxyphenyl)345678hexahydro(1)benzothieno(23b)pyridin2(1H)one
7tertbutyl4(4hydroxyphenyl)345678hexahydro1H(1)benzothiolo(23b)pyridin2one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(CC(=O)N3)C4=CC=C(C=C4)O
InChI=1SC21H25NO2Sc121(23)13691517(1013)252019(15)16(1118(24)2220)124714(23)8512h4578131623H6911H213H3(H2224)
MFCD10039426
ZINC000015106454
ZINC000015106463

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Available files

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