Vitas-M small molecule compound

4-(prop-2-en-1-yl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK450013
SMILES C=CCn1c(S)nnc1c1csc2c1CCCC2

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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 C13H15N3S2 MW 277.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3S2/c1-2-7-16-12(14-15-13(16)17)10-8-18-11-6-4-3-5-9(10)11/h2,8H,1,3-7H2,(H,15,17)
InChIKey
ACSLHLWGQNHDRT-UHFFFAOYSA-N
Synonyms
522597-46-2
4(prop2en1yl)5(4567tetrahydro1benzothiophen3yl)4H124triazole3thiol
4prop2enyl3(4567tetrahydro1benzothiophen3yl)1H124triazole5thione
522597462
C=CCN1C(=NNC1=S)C2=CSC3=C2CCCC3
InChI=1SC13H15N3S2c1271612(141513(16)17)108181164359(10)11h28H137H2(H1517)
MFCD03423442
ZINC000006492927
ZINC06492927
ZINC6492927

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Available files

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