Vitas-M small molecule compound
5-(2-chlorobenzyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione
Catalog ID
STK696131
SMILES S=C1NCN(CN1c1cccc(c1)C(F)(F)F)Cc1ccccc1Cl
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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/c18-15-7-2-1-4-12(15)9-23-10-22-16(25)24(11-23)14-6-3-5-13(8-14)17(19,20)21/h1-8H,9-11H2,(H,22,25)InChIKey
KBBATWOBLDGCCS-UHFFFAOYSA-NSynonyms
5((2chlorophenyl)methyl)1(3(trifluoromethyl)phenyl)135triazinane2thione
5(2chlorobenzyl)1(3(trifluoromethyl)phenyl)135triazinane2thione
C1NC(=S)N(CN1CC2=CC=CC=C2Cl)C3=CC=CC(=C3)C(F)(F)F
InChI=1SC17H15ClF3N3Sc1815721412(15)923102216(25)24(1123)1463513(814)17(1920)21h18H911H2(H2225)
MFCD08098299
ZINC000012375493
ZINC12375493
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