Vitas-M small molecule compound

5-(thiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK807559
SMILES S=c1[nH]nc(n1c1cccc(c1)C(F)(F)F)c1cccs1

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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 C13H8F3N3S2 MW 327.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8F3N3S2/c14-13(15,16)8-3-1-4-9(7-8)19-11(17-18-12(19)20)10-5-2-6-21-10/h1-7H,(H,18,20)
InChIKey
CGPYBQJSMCOZNH-UHFFFAOYSA-N
Synonyms

3(2THIENYL)4(3(TRIFLUOROMETHYL)PHENYL)124TRIAZOLINE5THIONE
3THIOPHEN2YL4(3(TRIFLUOROMETHYL)PHENYL)1H124TRIAZOLE5THIONE
5(thiophen2yl)4(3(trifluoromethyl)phenyl)24dihydro3H124triazole3thione
C1=CC(=CC(=C1)N2C(=NNC2=S)C3=CC=CS3)C(F)(F)F
InChI=1SC13H8F3N3S2c1413(1516)83149(78)1911(171812(19)20)105262110h17H(H1820)
MFCD04445532
S=c1(nH)nc(n1c1cccc(c1)C(F)(F)F)c1cccs1
ZINC000000615122
ZINC615122

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Available files

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