Vitas-M small molecule compound
5-benzyl-1-[2-chloro-5-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
Catalog ID
STK696110
SMILES S=C1NCN(CN1c1cc(ccc1Cl)C(F)(F)F)Cc1ccccc1
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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 C17H15ClF3N3S MW 385.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClF3N3S/c18-14-7-6-13(17(19,20)21)8-15(14)24-11-23(10-22-16(24)25)9-12-4-2-1-3-5-12/h1-8H,9-11H2,(H,22,25)InChIKey
RGECWNHDQXHOLI-UHFFFAOYSA-NSynonyms
5benzyl1(2chloro5(trifluoromethyl)phenyl)135triazinane2thione
C1NC(=S)N(CN1CC2=CC=CC=C2)C3=C(C=CC(=C3)C(F)(F)F)Cl
InChI=1SC17H15ClF3N3Sc18147613(17(1920)21)815(14)241123(102216(24)25)9124213512h18H911H2(H2225)
MFCD07081663
ZINC000012376429
ZINC12376429
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