Vitas-M small molecule compound
7-tert-butyl-4-{3-[(2-fluorobenzyl)oxy]-4-methoxyphenyl}-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridin-2(1H)-one
Catalog ID
STK693336
SMILES COc1ccc(cc1OCc1ccccc1F)C1CC(=O)Nc2c1c1CCC(Cc1s2)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 C29H32FNO3S MW 493.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32FNO3S/c1-29(2,3)19-10-11-20-25(14-19)35-28-27(20)21(15-26(32)31-28)17-9-12-23(33-4)24(13-17)34-16-18-7-5-6-8-22(18)30/h5-9,12-13,19,21H,10-11,14-16H2,1-4H3,(H,31,32)InChIKey
WAHZXCYLGQNCQF-UHFFFAOYSA-NSynonyms
7tertbutyl4(3((2fluorobenzyl)oxy)4methoxyphenyl)345678hexahydro(1)benzothieno(23b)pyridin2(1H)one
7tertbutyl4(3((2fluorophenyl)methoxy)4methoxyphenyl)345678hexahydro1H(1)benzothiolo(23b)pyridin2one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(CC(=O)N3)C4=CC(=C(C=C4)OC)OCC5=CC=CC=C5F
InChI=1SC29H32FNO3Sc129(23)1910112025(1419)352827(20)21(1526(32)3128)1791223(334)24(1317)341618756822(18)30h5912131921H10111416H214H3(H3132)
MFCD10039429
ZINC000015106488
ZINC000015106497
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