Vitas-M small molecule compound
1-(4-chlorophenyl)-5-(4-methoxybenzyl)-1,3,5-triazinane-2-thione
Catalog ID
STK696105
SMILES COc1ccc(cc1)CN1CNC(=S)N(C1)c1ccc(cc1)Cl
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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 C17H18ClN3OS MW 347.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3OS/c1-22-16-8-2-13(3-9-16)10-20-11-19-17(23)21(12-20)15-6-4-14(18)5-7-15/h2-9H,10-12H2,1H3,(H,19,23)InChIKey
XIGUSWKNOFCYQH-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)5((4methoxyphenyl)methyl)135triazinane2thione
1(4chlorophenyl)5(4methoxybenzyl)135triazinane2thione
COC1=CC=C(C=C1)CN2CNC(=S)N(C2)C3=CC=C(C=C3)Cl
InChI=1SC17H18ClN3OSc122168213(3916)1020111917(23)21(1220)156414(18)5715h29H1012H21H3(H1923)
MFCD06177236
ZINC000012420713
ZINC12420713
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