Vitas-M small molecule compound

4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK590173
SMILES CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl)C

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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 C18H16ClFN4OS MW 390.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClFN4OS/c1-11(2)25-13-6-3-5-12(9-13)17-22-23-18(26)24(17)21-10-14-15(19)7-4-8-16(14)20/h3-11H,1-2H3,(H,23,26)/b21-10+
InChIKey
OTBCQTDKXDTBFX-UFFVCSGVSA-N
Synonyms
679798-58-4
4(((E)(2chloro6fluorophenyl)methylidene)amino)5(3(propan2yloxy)phenyl)24dihydro3H124triazole3thione
4((1E)2(2CHLORO6FLUOROPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)(2chloro6fluorophenyl)methylideneamino)3(3propan2yloxyphenyl)1H124triazole5thione
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=C(C=CC=C3Cl)F
CC(Oc1cccc(c1)c1n(nH)c(=S)n1N=Cc1c(F)cccc1Cl)C
Registry IDs
MFCD07203821
ZINC000009087400
ZINC33772849

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Available files

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