Vitas-M small molecule compound
3-cyclohexyl-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK045713
SMILES CC(CCSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3)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 C21H30N2OS2 MW 390.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2OS2/c1-14(2)12-13-25-21-22-19-18(16-10-6-7-11-17(16)26-19)20(24)23(21)15-8-4-3-5-9-15/h14-15H,3-13H2,1-2H3InChIKey
MMZGNLGKPFONIH-UHFFFAOYSA-NSynonyms
351441-02-6351441026
3cyclohexyl2((3methylbutyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3cyclohexyl2(3methylbutylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3cyclohexyl2(isopentylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
CC(C)CCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4CCCCC4
CC(CCSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3)C
InChI=1SC21H30N2OS2c114(2)12132521221918(1610671117(16)2619)20(24)23(21)158435915h1415H313H212H3
MFCD01558698
STK045713
ZINC000002259791
ZINC02259791
ZINC2259791
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