Vitas-M small molecule compound
3-[(3-chlorobenzyl)sulfanyl]-4-methyl-5-(naphthalen-1-ylmethyl)-4H-1,2,4-triazole
Catalog ID
STK137741
SMILES Clc1cccc(c1)CSc1nnc(n1C)Cc1cccc2c1cccc2
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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 C21H18ClN3S MW 379.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3S/c1-25-20(13-17-9-5-8-16-7-2-3-11-19(16)17)23-24-21(25)26-14-15-6-4-10-18(22)12-15/h2-12H,13-14H2,1H3InChIKey
HVTYAEQSMDPFAL-UHFFFAOYSA-NSynonyms
3((3CHLOROBENZYL)SULFANYL)4METHYL5(NAPHTHALEN1YLMETHYL)4H124TRIAZOLE
3((3CHLOROPHENYL)METHYLSULFANYL)4METHYL5(NAPHTHALEN1YLMETHYL)124TRIAZOLE
CN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CC3=CC=CC4=CC=CC=C43
InChI=1SC21H18ClN3Sc12520(1317958167231119(16)17)232421(25)261415641018(22)1215h212H1314H21H3
MFCD03870455
ZINC000001129178
ZINC01129178
ZINC1129178
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