Vitas-M small molecule compound
5-(4-tert-butylphenyl)-4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK102927
SMILES Sc1nnc(n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-])c1ccc(cc1)C(C)(C)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 C19H18ClN5O2S MW 415.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O2S/c1-19(2,3)14-6-4-12(5-7-14)17-22-23-18(28)24(17)21-11-13-10-15(25(26)27)8-9-16(13)20/h4-11H,1-3H3,(H,23,28)/b21-11+InChIKey
OMFFLVJLTYTMAE-SRZZPIQSSA-NSynonyms
430451-83-5(E)5(4(tertbutyl)phenyl)4((2chloro5nitrobenzylidene)amino)4H124triazole3thiol
3(4TERTBUTYLPHENYL)4((E)(2CHLORO5NITROPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(2CHLORO5NITROPHENYL)1AZAVINYL)5(4(TERTBUTYL)PHENYL)124TRIAZOLE3THIOL
5(4TERTBUTYLPHENYL)4(((E)(2CHLORO5NITROPHENYL)METHYLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
5(4TERTBUTYLPHENYL)4(((E)(2CHLORO5NITROPHENYL)METHYLIDENE)AMINO)4H124TRIAZOLE3THIOL
CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC19H18ClN5O2Sc119(23)146412(5714)17222318(28)24(17)2111131015(25(26)27)8916(13)20h411H13H3(H2328)b2111+
MFCD02923932
Sc1nnc(n1N=Cc1cc(ccc1Cl)(N+)(=O)(O))c1ccc(cc1)C(C)(C)C
ZINC33360675
Check stock
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