Vitas-M small molecule compound
3-[(4-chlorobenzyl)sulfanyl]-5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK151526
SMILES Clc1ccc(cc1)CSc1nnc(n1c1ccccc1)COc1ccccc1
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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 C22H18ClN3OS MW 407.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3OS/c23-18-13-11-17(12-14-18)16-28-22-25-24-21(15-27-20-9-5-2-6-10-20)26(22)19-7-3-1-4-8-19/h1-14H,15-16H2InChIKey
PIETXYWJYOLJBT-UHFFFAOYSA-NSynonyms
3((4CHLOROBENZYL)SULFANYL)5(PHENOXYMETHYL)4PHENYL4H124TRIAZOLE
3((4CHLOROPHENYL)METHYLSULFANYL)5(PHENOXYMETHYL)4PHENYL124TRIAZOLE
3(4CHLOROBENZYLSULFANYL)5PHENOXYMETHYL4PHENYL4H(124)TRIAZOLE
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)Cl)COC4=CC=CC=C4
InChI=1SC22H18ClN3OSc2318131117(121418)162822252421(15272095261020)26(22)197314819h114H1516H2
MFCD02572320
ZINC000002854048
ZINC02854048
ZINC2854048
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