Vitas-M small molecule compound

4-{[(E)-(3-bromophenyl)methylidene]amino}-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK559777
SMILES Brc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1

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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 C15H11BrN4S MW 359.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11BrN4S/c16-13-8-4-5-11(9-13)10-17-20-14(18-19-15(20)21)12-6-2-1-3-7-12/h1-10H,(H,19,21)/b17-10+
InChIKey
GESPWZBVNAYMDX-LICLKQGHSA-N
Synonyms
1630031-37-6
1630031376
4(((E)(3bromophenyl)methylidene)amino)5phenyl24dihydro3H124triazole3thione
4((3BROMOBENZYLIDENE)AMINO)5PHENYL4H(124)TRIAZOLE3THIOL
4((E)(3BROMOPHENYL)METHYLIDENEAMINO)3PHENYL1H124TRIAZOLE5THIONE
Brc1cccc(c1)C=Nn1c(=S)(nH)nc1c1ccccc1
InChI=1SC15H11BrN4Sc161384511(913)10172014(181915(20)21)126213712h110H(H1921)b1710+
MFCD03799384
ZINC000001755219
ZINC04679897
ZINC4679897

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.