Vitas-M small molecule compound

5-(4-ethyl-5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK450024
SMILES C=CCn1c(S)nnc1c1csc(c1CC)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 C12H15N3S2 MW 265.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3S2/c1-4-6-15-11(13-14-12(15)16)10-7-17-8(3)9(10)5-2/h4,7H,1,5-6H2,2-3H3,(H,14,16)
InChIKey
MPJVRRILZIGBDP-UHFFFAOYSA-N
Synonyms
522597-63-3
3(4ETHYL5METHYLTHIOPHEN3YL)4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5(4ETHYL5METHYLTHIEN3YL)4H124TRIAZOLE3THIOL
5(4ETHYL5METHYL(3THIENYL))4PROP2ENYL124TRIAZOLE3THIOL
5(4ETHYL5METHYLTHIOPHEN3YL)4(PROP2EN1YL)124TRIAZOLE3THIOL
5(4ethyl5methylthiophen3yl)4(prop2en1yl)4H124triazole3thiol
522597633
CCC1=C(SC=C1C2=NNC(=S)N2CC=C)C
InChI=1SC12H15N3S2c1461511(131412(15)16)107178(3)9(10)52h47H156H223H3(H1416)
MFCD03423437
ZINC000006519531
ZINC06519531
ZINC6519531

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Available files

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