Vitas-M small molecule compound

4-(benzylideneamino)-5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK105754
SMILES Clc1ccc(cc1)c1nnc(n1/N=C\c1ccccc1)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 C15H11ClN4S MW 314.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11ClN4S/c16-13-8-6-12(7-9-13)14-18-19-15(21)20(14)17-10-11-4-2-1-3-5-11/h1-10H,(H,19,21)
InChIKey
QMEAJRWAEVGIKA-UHFFFAOYSA-N
Synonyms

(E)4(benzylideneamino)5(4chlorophenyl)4H124triazole3thiol
4((1Z)2PHENYL1AZAVINYL)5(4CHLOROPHENYL)124TRIAZOLE3THIOL
4(BENZYLIDENEAMINO)3(4CHLOROPHENYL)1H124TRIAZOLE5THIONE
4(BENZYLIDENEAMINO)5(4CHLOROPHENYL)4H124TRIAZOLE3THIOL
C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)Cl
Clc1ccc(cc1)c1nnc(n1N=Cc1ccccc1)S
InChI=1SC15H11ClN4Sc16138612(7913)14181915(21)20(14)1710114213511h110H(H1921)
MFCD03218319
ZINC000252429448

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Available files

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