Vitas-M small molecule compound
ethyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK054487
SMILES CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3
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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 C20H26N2O3S2 MW 406.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O3S2/c1-2-25-16(23)12-26-20-21-18-17(14-10-6-7-11-15(14)27-18)19(24)22(20)13-8-4-3-5-9-13/h13H,2-12H2,1H3InChIKey
VTBINPJISLNMHG-UHFFFAOYSA-NSynonyms
328072-81-7328072817
CCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4CCCCC4
CCOC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3
ethyl((3cyclohexyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((3cyclohexyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetate
ethyl2((3cyclohexyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
InChI=1SC20H26N2O3S2c122516(23)122620211817(1410671115(14)2718)19(24)22(20)138435913h13H212H21H3
MFCD00128318
STK054487
ZINC000000805692
ZINC00805692
ZINC805692
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