Vitas-M small molecule compound
6-hydroxy-2-[(4-nitrobenzyl)sulfanyl]-5-phenylpyrimidin-4(3H)-one
Catalog ID
STK213712
SMILES Oc1nc(SCc2ccc(cc2)[N+](=O)[O-])[nH]c(=O)c1c1ccccc1
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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 C17H13N3O4S MW 355.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O4S/c21-15-14(12-4-2-1-3-5-12)16(22)19-17(18-15)25-10-11-6-8-13(9-7-11)20(23)24/h1-9H,10H2,(H2,18,19,21,22)InChIKey
SOZLLFSKQNPBJM-UHFFFAOYSA-NSynonyms
878979-62-54HYDROXY2((4NITROPHENYL)METHYLSULFANYL)5PHENYL1HPYRIMIDIN6ONE
6HYDROXY2((4NITROBENZYL)SULFANYL)5PHENYLPYRIMIDIN4(3H)ONE
878979625
C1=CC=C(C=C1)C2=C(N=C(NC2=O)SCC3=CC=C(C=C3)(N+)(=O)(O))O
InChI=1SC17H13N3O4Sc211514(124213512)16(22)1917(1815)2510116813(9711)20(23)24h19H10H2(H218192122)
MFCD07087322
Oc1nc(SCc2ccc(cc2)(N+)(=O)(O))(nH)c(=O)c1c1ccccc1
ZINC000010059013
ZINC10059013
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