Vitas-M small molecule compound
3-[(3-methoxybenzyl)sulfanyl]-4-methyl-5-(2-methylphenyl)-4H-1,2,4-triazole
Catalog ID
STK454511
SMILES COc1cccc(c1)CSc1nnc(n1C)c1ccccc1C
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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 C18H19N3OS MW 325.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3OS/c1-13-7-4-5-10-16(13)17-19-20-18(21(17)2)23-12-14-8-6-9-15(11-14)22-3/h4-11H,12H2,1-3H3InChIKey
HQCWPZRQOFHWDE-UHFFFAOYSA-NSynonyms
1METHOXY3((4METHYL5(2METHYLPHENYL)(124TRIAZOL3YLTHIO))METHYL)BENZENE
3((3methoxybenzyl)sulfanyl)4methyl5(2methylphenyl)4H124triazole
3((3METHOXYPHENYL)METHYLSULFANYL)4METHYL5(2METHYLPHENYL)124TRIAZOLE
CC1=CC=CC=C1C2=NN=C(N2C)SCC3=CC(=CC=C3)OC
InChI=1SC18H19N3OSc1137451016(13)17192018(21(17)2)23121486915(1114)223h411H12H213H3
MFCD04226829
ZINC000005859971
ZINC05859971
ZINC5859971
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