Vitas-M small molecule compound

5-ethyl-4-(propan-2-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK502634
SMILES CCc1nnc(n1C(C)C)S

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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 C7H13N3S MW 171.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H13N3S/c1-4-6-8-9-7(11)10(6)5(2)3/h5H,4H2,1-3H3,(H,9,11)
InChIKey
QWSRQDOKMZEDAI-UHFFFAOYSA-N
Synonyms
869941-86-6
3ethyl4propan2yl1H124triazole5thione
5ETHYL4(PROPAN2YL)4H124TRIAZOLE3THIOL
5ETHYL4ISOPROPYL124TRIAZOLE3THIOL
5ETHYL4ISOPROPYL4H124TRIAZOLE3THIOL
869941866
CCC1=NNC(=S)N1C(C)C
InChI=1SC7H13N3Sc146897(11)10(6)5(2)3h5H4H213H3(H911)
MFCD03423408
ZINC000002569117
ZINC02569117
ZINC2569117

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Available files

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