Vitas-M small molecule compound
3-[(2-methylbenzyl)sulfanyl]-5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK472287
SMILES C=CCn1c(nnc1COc1ccccc1)SCc1ccccc1C
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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 C20H21N3OS MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3OS/c1-3-13-23-19(14-24-18-11-5-4-6-12-18)21-22-20(23)25-15-17-10-8-7-9-16(17)2/h3-12H,1,13-15H2,2H3InChIKey
KORQBRLDSKYXSJ-UHFFFAOYSA-NSynonyms
((5((2METHYLPHENYL)METHYLTHIO)4PROP2ENYL124TRIAZOL3YL)METHOXY)BENZENE
3((2methylbenzyl)sulfanyl)5(phenoxymethyl)4(prop2en1yl)4H124triazole
3((2methylphenyl)methylsulfanyl)5(phenoxymethyl)4prop2enyl124triazole
CC1=CC=CC=C1CSC2=NN=C(N2CC=C)COC3=CC=CC=C3
InChI=1SC20H21N3OSc13132319(142418115461218)212220(23)2515171087916(17)2h312H11315H22H3
MFCD07035575
ZINC000017072957
ZINC17072957
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