Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidine-5-carbonitrile
Catalog ID
STK123982
SMILES N#Cc1c(=O)[nH]c(nc1c1ccc(cc1)OC)SCc1ccccc1Cl
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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 C19H14ClN3O2S MW 383.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O2S/c1-25-14-8-6-12(7-9-14)17-15(10-21)18(24)23-19(22-17)26-11-13-4-2-3-5-16(13)20/h2-9H,11H2,1H3,(H,22,23,24)InChIKey
BGXXBBGEOZNWNX-UHFFFAOYSA-NSynonyms
404910-68-52((2CHLOROBENZYL)SULFANYL)4(4METHOXYPHENYL)6OXO16DIHYDROPYRIMIDINE5CARBONITRILE
2((2CHLOROPHENYL)METHYLSULFANYL)6(4METHOXYPHENYL)4OXO1HPYRIMIDINE5CARBONITRILE
404910685
COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC3=CC=CC=C3Cl)C#N
InChI=1SC19H14ClN3O2Sc125148612(7914)1715(1021)18(24)2319(2217)261113423516(13)20h29H11H21H3(H222324)
MFCD02042207
N#Cc1c(=O)(nH)c(nc1c1ccc(cc1)OC)SCc1ccccc1Cl
ZINC000002751089
ZINC02751089
ZINC2751089
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