Vitas-M small molecule compound
4-(4-hydroxybutyl)-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK636619
SMILES OCCCCn1c(n[nH]c1=S)c1ccccc1
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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 C12H15N3OS MW 249.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3OS/c16-9-5-4-8-15-11(13-14-12(15)17)10-6-2-1-3-7-10/h1-3,6-7,16H,4-5,8-9H2,(H,14,17)InChIKey
CTEQVZVHHMLZKR-UHFFFAOYSA-NSynonyms
947884-63-14(4hydroxybutyl)3phenyl1H124triazole5thione
4(4hydroxybutyl)5phenyl24dihydro3H124triazole3thione
947884631
C1=CC=C(C=C1)C2=NNC(=S)N2CCCCO
InChI=1SC12H15N3OSc1695481511(131412(15)17)106213710h136716H4589H2(H1417)
MFCD18161114
OCCCCn1c(n(nH)c1=S)c1ccccc1
ZINC000010312533
ZINC10312533
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