Vitas-M small molecule compound

5-(4-tert-butylphenyl)-4-{[(E)-(3-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK106975
SMILES Cc1cccc(c1)/C=N/n1c(S)nnc1c1ccc(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 C20H22N4S MW 350.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4S/c1-14-6-5-7-15(12-14)13-21-24-18(22-23-19(24)25)16-8-10-17(11-9-16)20(2,3)4/h5-13H,1-4H3,(H,23,25)/b21-13+
InChIKey
RJPHBHUWNZXADN-FYJGNVAPSA-N
Synonyms
430453-75-1
(E)5(4(tertbutyl)phenyl)4((3methylbenzylidene)amino)4H124triazole3thiol
3(4TERTBUTYLPHENYL)4((E)(3METHYLPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(3METHYLPHENYL)1AZAVINYL)5(4(TERTBUTYL)PHENYL)124TRIAZOLE3THIOL
5(4TERTBUTYLPHENYL)4(((E)(3METHYLPHENYL)METHYLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
5(4TERTBUTYLPHENYL)4(((E)(3METHYLPHENYL)METHYLIDENE)AMINO)4H124TRIAZOLE3THIOL
CC1=CC=CC(=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)C(C)(C)C
Cc1cccc(c1)C=Nn1c(S)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC20H22N4Sc11465715(1214)13212418(222319(24)25)1681017(11916)20(23)4h513H14H3(H2325)b2113+
MFCD03138553
ZINC02342645
ZINC2342645

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Available files

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