Vitas-M small molecule compound
3-ethyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STL305770
SMILES CCn1c(=S)[nH]c2c(c1=O)c1CCCCCc1s2
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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/c1-2-15-12(16)10-8-6-4-3-5-7-9(8)18-11(10)14-13(15)17/h2-7H2,1H3,(H,14,17)InChIKey
LCZHFPBORGBNNM-UHFFFAOYSA-NSynonyms
132605-27-7132605277
3ethyl2sulfanylidene156789hexahydrocyclohepta(23)thieno(24b)pyrimidin4one
3ethyl2thioxo12356789octahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
CCN1C(=O)C2=C(NC1=S)SC3=C2CCCCC3
CCn1c(=S)(nH)c2c(c1=O)c1CCCCCc1s2
InChI=1SC13H16N2OS2c121512(16)108643579(8)1811(10)1413(15)17h27H21H3(H1417)
MFCD01745662
ZINC000006371733
ZINC06371733
ZINC6371733
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