Vitas-M small molecule compound

4-methyl-3-(3-methylphenyl)-5-[(naphthalen-1-ylmethyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK697119
SMILES Cc1cccc(c1)c1nnc(n1C)SCc1cccc2c1cccc2

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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 C21H19N3S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3S/c1-15-7-5-10-17(13-15)20-22-23-21(24(20)2)25-14-18-11-6-9-16-8-3-4-12-19(16)18/h3-13H,14H2,1-2H3
InChIKey
HSAXDCVTTAOPIA-UHFFFAOYSA-N
Synonyms
893175-81-0
4methyl3((naphthalen1ylmethyl)thio)5(mtolyl)4H124triazole
4methyl3(3methylphenyl)5((naphthalen1ylmethyl)sulfanyl)4H124triazole
4METHYL3(3METHYLPHENYL)5(NAPHTHALEN1YLMETHYLSULFANYL)124TRIAZOLE
4METHYL5(3METHYLPHENYL)3(NAPHTHYLMETHYLTHIO)124TRIAZOLE
893175810
CC1=CC=CC(=C1)C2=NN=C(N2C)SCC3=CC=CC4=CC=CC=C43
InChI=1SC21H19N3Sc115751017(1315)20222321(24(20)2)2514181169168341219(16)18h313H14H212H3
MFCD06111174
ZINC000002439679
ZINC02439679
ZINC2439679

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Available files

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