Vitas-M small molecule compound
4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-cyclohexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL039563
SMILES Clc1ccc(cc1/C=N/n1c(=S)[nH]nc1C1CCCCC1)[N+](=O)[O-]
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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 C15H16ClN5O2S MW 365.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16ClN5O2S/c16-13-7-6-12(21(22)23)8-11(13)9-17-20-14(18-19-15(20)24)10-4-2-1-3-5-10/h6-10H,1-5H2,(H,19,24)/b17-9+InChIKey
NBBDKPIFSBNFRC-RQZCQDPDSA-NSynonyms
500104-47-24(((E)(2chloro5nitrophenyl)methylidene)amino)5cyclohexyl24dihydro3H124triazole3thione
4((E)(2CHLORO5NITROPHENYL)METHYLIDENEAMINO)3CYCLOHEXYL1H124TRIAZOLE5THIONE
500104472
InChI=1SC15H16ClN5O2Sc16137612(21(22)23)811(13)9172014(181915(20)24)104213510h610H15H2(H1924)b179+
MFCD03818723
ZINC000015987991
ZINC15987990
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