Vitas-M small molecule compound
3-(1H-pyrazol-3-ylmethyl)-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK439899
SMILES Sc1nc2sc3c(c2c(=O)n1Cc1n[nH]cc1)CCC3
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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 C13H12N4OS2 MW 304.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4OS2/c18-12-10-8-2-1-3-9(8)20-11(10)15-13(19)17(12)6-7-4-5-14-16-7/h4-5H,1-3,6H2,(H,14,16)(H,15,19)InChIKey
KWDMLQHDEVVXCY-UHFFFAOYSA-NSynonyms
2(1Hpyrazol5ylmethyl)3sulfanylidene4678tetrahydrocyclopenta(23)thieno(24b)pyrimidin1one
3(1Hpyrazol3ylmethyl)2sulfanyl3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
C1CC2=C(C1)SC3=C2C(=O)N(C(=S)N3)CC4=CC=NN4
InChI=1SC13H12N4OS2c18121082139(8)2011(10)1513(19)17(12)674514167h45H136H2(H1416)(H1519)
MFCD03946079
Sc1nc2sc3c(c2c(=O)n1Cc1n(nH)cc1)CCC3
ZINC000017031105
ZINC17031105
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