Vitas-M small molecule compound

4-methyl-3-phenyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole

Catalog ID
STK865623
SMILES Cn1c(SC/C=C/c2ccccc2)nnc1c1ccccc1

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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 C18H17N3S MW 307.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3S/c1-21-17(16-12-6-3-7-13-16)19-20-18(21)22-14-8-11-15-9-4-2-5-10-15/h2-13H,14H2,1H3/b11-8+
InChIKey
ITRXXAIDRFOLAH-DHZHZOJOSA-N
Synonyms
676152-26-4
3(cinnamylthio)4methyl5phenyl4H124triazole
4methyl3phenyl5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
4METHYL3PHENYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
676152264
CN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CC=CC=C3
Cn1c(SCC=Cc2ccccc2)nnc1c1ccccc1
InChI=1SC18H17N3Sc12117(16126371316)192018(21)22148111594251015h213H14H21H3b118+
MFCD03710249
ZINC000002450866
ZINC02450866
ZINC2450866

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Available files

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