Vitas-M small molecule compound

5-(4-tert-butylphenyl)-4-[(thiophen-2-ylmethylidene)amino]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK102464
SMILES Sc1nnc(n1/N=C/c1cccs1)c1ccc(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 C17H18N4S2 MW 342.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4S2/c1-17(2,3)13-8-6-12(7-9-13)15-19-20-16(22)21(15)18-11-14-5-4-10-23-14/h4-11H,1-3H3,(H,20,22)
InChIKey
VDFOXRYEIZNRLG-UHFFFAOYSA-N
Synonyms

(E)5(4(tertbutyl)phenyl)4((thiophen2ylmethylene)amino)4H124triazole3thiol
3(4TERTBUTYLPHENYL)4(THIOPHEN2YLMETHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(2THIENYL)1AZAVINYL)5(4(TERTBUTYL)PHENYL)124TRIAZOLE3THIOL
5(4TERTBUTYLPHENYL)4((THIOPHEN2YLMETHYLIDENE)AMINO)4H124TRIAZOLE3THIOL
CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=CS3
InChI=1SC17H18N4S2c117(23)138612(7913)15192016(22)21(15)18111454102314h411H13H3(H2022)
MFCD03218200
Sc1nnc(n1N=Cc1cccs1)c1ccc(cc1)C(C)(C)C
ZINC000239231209
ZINC01244870

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Available files

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