Vitas-M small molecule compound

5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazole-3-thiol

Catalog ID
STK115168
SMILES CCc1ccc(cc1)OC(c1nnc(n1C)S)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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-4-10-5-7-11(8-6-10)17-9(2)12-14-15-13(18)16(12)3/h5-9H,4H2,1-3H3,(H,15,18)
InChIKey
XDNIAMZOUKRHDH-UHFFFAOYSA-N
Synonyms
669708-93-4
3(1(4ETHYLPHENOXY)ETHYL)4METHYL1H124TRIAZOLE5THIONE
5((4ETHYLPHENOXY)ETHYL)4METHYL124TRIAZOLE3THIOL
5(1(4ETHYLPHENOXY)ETHYL)4METHYL124TRIAZOLE3THIOL
5(1(4ETHYLPHENOXY)ETHYL)4METHYL4H(124)TRIAZOLE3THIOL
5(1(4ETHYLPHENOXY)ETHYL)4METHYL4H124TRIAZOLE3THIOL
669708934
CCC1=CC=C(C=C1)OC(C)C2=NNC(=S)N2C
InChI=1SC13H17N3OSc14105711(8610)179(2)12141513(18)16(12)3h59H4H213H3(H1518)
MFCD04057657
ZINC000005908912
ZINC000005908914

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Available files

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