Vitas-M small molecule compound

4-[(4-tert-butylbenzylidene)amino]-5-phenyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK109704
SMILES Sc1nnc(n1/N=C\c1ccc(cc1)C(C)(C)C)c1ccccc1

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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 C19H20N4S MW 336.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4S/c1-19(2,3)16-11-9-14(10-12-16)13-20-23-17(21-22-18(23)24)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,22,24)
InChIKey
CDWCHFHQQWAUSC-UHFFFAOYSA-N
Synonyms

(E)4((4(tertbutyl)benzylidene)amino)5phenyl4H124triazole3thiol
4((4TERTBUTYLBENZYLIDENE)AMINO)5PHENYL4H124TRIAZOLE3THIOL
4((4TERTBUTYLPHENYL)METHYLIDENEAMINO)3PHENYL1H124TRIAZOLE5THIONE
CC(C)(C)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=CC=C3
InChI=1SC19H20N4Sc119(23)1611914(101216)13202317(212218(23)24)157546815h413H13H3(H2224)
MFCD03218393
ZINC000239030650

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Available files

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