Vitas-M small molecule compound
7-tert-butyl-2-[(E)-2-phenylethenyl]-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STL456220
SMILES OC1=NC(/C=C/c2ccccc2)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 C22H26N2OS MW 366.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS/c1-22(2,3)15-10-11-16-17(13-15)26-21-19(16)20(25)23-18(24-21)12-9-14-7-5-4-6-8-14/h4-9,12,15,18,24H,10-11,13H2,1-3H3,(H,23,25)/b12-9+InChIKey
SXHAKQLTSBVHCG-FMIVXFBMSA-NSynonyms
7tertbutyl2((E)2phenylethenyl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
7tertbutyl2((E)2phenylethenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C=CC4=CC=CC=C4
InChI=1SC22H26N2OSc122(23)1510111617(1315)262119(16)20(25)2318(2421)129147546814h4912151824H101113H213H3(H2325)b129+
MFCD07773804
OC1=NC(C=Cc2ccccc2)Nc2c1c1CCC(Cc1s2)C(C)(C)C
ZINC000005274746
ZINC000006906283
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