Vitas-M small molecule compound
5-(2-fluorophenyl)-4-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK581250
SMILES CCCCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F
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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 C20H21FN4OS MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN4OS/c1-2-3-6-13-26-16-11-9-15(10-12-16)14-22-25-19(23-24-20(25)27)17-7-4-5-8-18(17)21/h4-5,7-12,14H,2-3,6,13H2,1H3,(H,24,27)/b22-14+InChIKey
RPIGUDAXGDLPCF-HYARGMPZSA-NSynonyms
738622-93-03(2FLUOROPHENYL)4((4(PENTYLOXY)BENZYLIDENE)AMINO)1H124TRIAZOLE5(4H)THIONE
3(2fluorophenyl)4((E)(4pentoxyphenyl)methylideneamino)1H124triazole5thione
4((1E)2(4PENTYLOXYPHENYL)1AZAVINYL)5(2FLUOROPHENYL)124TRIAZOLE3THIOL
5(2fluorophenyl)4(((E)(4(pentyloxy)phenyl)methylidene)amino)24dihydro3H124triazole3thione
738622930
CCCCCOC1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=CC=C3F
CCCCCOc1ccc(cc1)C=Nn1c(=S)(nH)nc1c1ccccc1F
InChI=1SC20H21FN4OSc123613261611915(101216)14222519(232420(25)27)17745818(17)21h4571214H23613H21H3(H2427)b2214+
MFCD07201163
ZINC000005735265
ZINC33361365
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