Vitas-M small molecule compound
4-({[4-(1,3-benzodioxol-5-yl)pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK922331
SMILES N#Cc1ccc(cc1)CSc1nccc(n1)c1ccc2c(c1)OCO2
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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 C19H13N3O2S MW 347.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O2S/c20-10-13-1-3-14(4-2-13)11-25-19-21-8-7-16(22-19)15-5-6-17-18(9-15)24-12-23-17/h1-9H,11-12H2InChIKey
WPZLYPORVLEEEF-UHFFFAOYSA-NSynonyms
923107-63-54(((4(13benzodioxol5yl)pyrimidin2yl)sulfanyl)methyl)benzonitrile
4(((4(BENZO(D)(13)DIOXOL5YL)PYRIMIDIN2YL)THIO)METHYL)BENZONITRILE
4((4(13benzodioxol5yl)pyrimidin2yl)sulfanylmethyl)benzonitrile
4((4(2HBENZO(34D)13DIOXOLEN5YL)PYRIMIDIN2YLTHIO)METHYL)BENZENECARBONITRILE
923107635
C1OC2=C(O1)C=C(C=C2)C3=NC(=NC=C3)SCC4=CC=C(C=C4)C#N
InChI=1SC19H13N3O2Sc2010131314(4213)112519218716(2219)15561718(915)24122317h19H1112H2
MFCD08532814
ZINC000009970842
ZINC09970842
ZINC9970842
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