Vitas-M small molecule compound

5-(3,5-dimethoxyphenyl)-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK868479
SMILES C=CCn1c(=S)[nH]nc1c1cc(OC)cc(c1)OC

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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 C13H15N3O2S MW 277.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O2S/c1-4-5-16-12(14-15-13(16)19)9-6-10(17-2)8-11(7-9)18-3/h4,6-8H,1,5H2,2-3H3,(H,15,19)
InChIKey
GQNBPSAIMKYLNC-UHFFFAOYSA-N
Synonyms
428836-28-6
3(35DIMETHOXYPHENYL)4PROP2ENYL1H124TRIAZOLE5THIONE
428836286
4allyl3(35dimethoxyphenyl)1H124triazole5(4H)thione
4ALLYL3(35DIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
5(35dimethoxyphenyl)4(prop2en1yl)24dihydro3H124triazole3thione
C=CCn1c(=S)(nH)nc1c1cc(OC)cc(c1)OC
COC1=CC(=CC(=C1)C2=NNC(=S)N2CC=C)OC
InChI=1SC13H15N3O2Sc1451612(141513(16)19)9610(172)811(79)183h468H15H223H3(H1519)
MFCD02375619
ZINC000002477764
ZINC02477764
ZINC2477764

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Available files

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