Vitas-M small molecule compound
5-(4-tert-butylphenyl)-4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL040240
SMILES [O-][N+](=O)c1cc(ccc1Cl)/C=N/n1c(=S)[nH]nc1c1ccc(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)14-7-5-13(6-8-14)17-22-23-18(28)24(17)21-11-12-4-9-15(20)16(10-12)25(26)27/h4-11H,1-3H3,(H,23,28)/b21-11+InChIKey
GNDBUUVSEVJQFH-SRZZPIQSSA-NSynonyms
430451-90-4(O)(N+)(=O)c1cc(ccc1Cl)C=Nn1c(=S)(nH)nc1c1ccc(cc1)C(C)(C)C
430451904
MFCD03818581
ZINC000002345611
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