Vitas-M small molecule compound
4-benzyl-5-(4-nitrophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK693887
SMILES Sc1nnc(n1Cc1ccccc1)c1ccc(cc1)[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 C15H12N4O2S MW 312.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O2S/c20-19(21)13-8-6-12(7-9-13)14-16-17-15(22)18(14)10-11-4-2-1-3-5-11/h1-9H,10H2,(H,17,22)InChIKey
FNPPASJCBXHHNZ-UHFFFAOYSA-NSynonyms
4BENZYL3(4NITROPHENYL)1H124TRIAZOLE5THIONE
4benzyl5(4nitrophenyl)4H124triazole3thiol
5(4NITROPHENYL)4BENZYL124TRIAZOLE3THIOL
C1=CC=C(C=C1)CN2C(=NNC2=S)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC15H12N4O2Sc2019(21)138612(7913)14161715(22)18(14)10114213511h19H10H2(H1722)
MFCD01829302
Sc1nnc(n1Cc1ccccc1)c1ccc(cc1)(N+)(=O)(O)
ZINC000006344370
ZINC6344370
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