Vitas-M small molecule compound

5-(2,4-dichlorophenyl)-4-[(4-nitrobenzylidene)amino]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK107381
SMILES Clc1ccc(c(c1)Cl)c1nnc(n1/N=C/c1ccc(cc1)[N+](=O)[O-])S

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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 C15H9Cl2N5O2S MW 394.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9Cl2N5O2S/c16-10-3-6-12(13(17)7-10)14-19-20-15(25)21(14)18-8-9-1-4-11(5-2-9)22(23)24/h1-8H,(H,20,25)
InChIKey
GOOQPHLVRPCNFW-UHFFFAOYSA-N
Synonyms

(E)5(24dichlorophenyl)4((4nitrobenzylidene)amino)4H124triazole3thiol
3(24DICHLOROPHENYL)4((4NITROPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(4NITROPHENYL)1AZAVINYL)5(24DICHLOROPHENYL)124TRIAZOLE3THIOL
5(24DICHLOROPHENYL)4((4NITROBENZYLIDENE)AMINO)4H124TRIAZOLE3THIOL
C1=CC(=CC=C1C=NN2C(=NNC2=S)C3=C(C=C(C=C3)Cl)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)Cl)c1nnc(n1N=Cc1ccc(cc1)(N+)(=O)(O))S
InChI=1SC15H9Cl2N5O2Sc16103612(13(17)710)14192015(25)21(14)18891411(529)22(23)24h18H(H2025)
MFCD02924094
ZINC000252429354

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Available files

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