Vitas-M small molecule compound
5-butyl-1-(4-fluorophenyl)-1,3,5-triazinane-2-thione
Catalog ID
STK696096
SMILES CCCCN1CNC(=S)N(C1)c1ccc(cc1)F
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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 C13H18FN3S MW 267.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18FN3S/c1-2-3-8-16-9-15-13(18)17(10-16)12-6-4-11(14)5-7-12/h4-7H,2-3,8-10H2,1H3,(H,15,18)InChIKey
VDIGBXVHIXWHDL-UHFFFAOYSA-NSynonyms
135TRIAZINE2(1H)THIONE5BUTYL1(4FLUOROPHENYL)TETRAHYDRO
5butyl1(4fluorophenyl)135triazinane2thione
CCCCN1CNC(=S)N(C1)C2=CC=C(C=C2)F
InChI=1SC13H18FN3Sc12381691513(18)17(1016)126411(14)5712h47H23810H21H3(H1518)
MFCD06177173
ZINC000012420057
ZINC12420057
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