Vitas-M small molecule compound
4-{[(E)-(2-chloro-6-fluorophenyl)methylidene]amino}-5-(3-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK590769
SMILES Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(F)cccc1Cl
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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 C16H12ClFN4S MW 346.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClFN4S/c1-10-4-2-5-11(8-10)15-20-21-16(23)22(15)19-9-12-13(17)6-3-7-14(12)18/h2-9H,1H3,(H,21,23)/b19-9+InChIKey
XXPUHZCGJTUYQV-DJKKODMXSA-NSynonyms
478255-65-14(((E)(2chloro6fluorophenyl)methylidene)amino)5(3methylphenyl)24dihydro3H124triazole3thione
4((2CHLORO6FLUOROBENZYLIDENE)AMINO)3(MTOLYL)1H124TRIAZOLE5(4H)THIONE
4((E)(2CHLORO6FLUOROPHENYL)METHYLIDENEAMINO)3(3METHYLPHENYL)1H124TRIAZOLE5THIONE
478255651
CC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=C(C=CC=C3Cl)F
Cc1cccc(c1)c1n(nH)c(=S)n1N=Cc1c(F)cccc1Cl
InChI=1SC16H12ClFN4Sc11042511(810)15202116(23)22(15)1991213(17)63714(12)18h29H1H3(H2123)b199+
MFCD07200731
ZINC000005981731
ZINC33326271
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