Vitas-M small molecule compound
2-(propan-2-ylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL444019
SMILES CC(Sc1nc2sc3c(c2c(=O)[nH]1)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 C13H16N2OS2 MW 280.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2OS2/c1-7(2)17-13-14-11(16)10-8-5-3-4-6-9(8)18-12(10)15-13/h7H,3-6H2,1-2H3,(H,14,15,16)InChIKey
QRWDNLQIQLWDOT-UHFFFAOYSA-NSynonyms
2(propan2ylsulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2propan2ylsulfanyl5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC(C)SC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1
CC(Sc1nc2sc3c(c2c(=O)(nH)1)CCCC3)C
InChI=1SC13H16N2OS2c17(2)17131411(16)10853469(8)1812(10)1513h7H36H212H3(H141516)
MFCD05394395
ZINC000008640478
ZINC8640478
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