Vitas-M small molecule compound
2-(2-ethoxyphenyl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK383915
SMILES CCOc1ccccc1C1N=C(O)c2c(N1)sc1c2CCC(C1)C(CC)(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 C23H30N2O2S MW 398.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O2S/c1-5-23(3,4)14-11-12-16-18(13-14)28-22-19(16)21(26)24-20(25-22)15-9-7-8-10-17(15)27-6-2/h7-10,14,20,25H,5-6,11-13H2,1-4H3,(H,24,26)InChIKey
KXHUPHYZOZLTGS-UHFFFAOYSA-NSynonyms
2(2ethoxyphenyl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(2ethoxyphenyl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=CC=C4OCC
InChI=1SC23H30N2O2Sc1523(34)1411121618(1314)282219(16)21(26)2420(2522)159781017(15)2762h710142025H561113H214H3(H2426)
MFCD03848773
ZINC000004554734
ZINC000004554737
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