Vitas-M small molecule compound
3-{[(4-oxo-3-pentyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STL125689
SMILES CCCCCn1c(SCc2cccc(c2)C#N)nc2c(c1=O)scc2
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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 C19H19N3OS2 MW 369.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3OS2/c1-2-3-4-9-22-18(23)17-16(8-10-24-17)21-19(22)25-13-15-7-5-6-14(11-15)12-20/h5-8,10-11H,2-4,9,13H2,1H3InChIKey
JELHCOIROHSBKS-UHFFFAOYSA-NSynonyms
3(((4oxo3pentyl34dihydrothieno(32d)pyrimidin2yl)sulfanyl)methyl)benzonitrile
3((4oxo3pentylthieno(32d)pyrimidin2yl)sulfanylmethyl)benzonitrile
CCCCCN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=CC(=C3)C#N
InChI=1SC19H19N3OS2c123492218(23)1716(8102417)2119(22)25131575614(1115)1220h581011H24913H21H3
MFCD20738111
ZINC000067259664
ZINC67259664
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