Vitas-M small molecule compound
2-(2-ethoxynaphthalen-1-yl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK383240
SMILES CCOc1ccc2c(c1C1N=C(O)c3c(N1)sc1c3CCC(C1)C(CC)(C)C)cccc2
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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 C27H32N2O2S MW 448.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O2S/c1-5-27(3,4)17-12-13-19-21(15-17)32-26-23(19)25(30)28-24(29-26)22-18-10-8-7-9-16(18)11-14-20(22)31-6-2/h7-11,14,17,24,29H,5-6,12-13,15H2,1-4H3,(H,28,30)InChIKey
RBTXLRLOHAHMCJ-UHFFFAOYSA-NSynonyms
2(2ethoxynaphthalen1yl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(2ethoxynaphthalen1yl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC5=CC=CC=C54)OCC
InChI=1SC27H32N2O2Sc1527(34)1712131921(1517)322623(19)25(30)2824(2926)22181087916(18)111420(22)3162h71114172429H56121315H214H3(H2830)
MFCD03835570
ZINC000015946156
ZINC000015946162
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