Vitas-M small molecule compound

3-[(3-chlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole

Catalog ID
STK467866
SMILES COc1ccc(cc1)c1nnc(n1C)SCc1cccc(c1)Cl

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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 C17H16ClN3OS MW 345.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3OS/c1-21-16(13-6-8-15(22-2)9-7-13)19-20-17(21)23-11-12-4-3-5-14(18)10-12/h3-10H,11H2,1-2H3
InChIKey
FMTCJBBHFZUMDI-UHFFFAOYSA-N
Synonyms

1(5((3CHLOROPHENYL)METHYLTHIO)4METHYL(124TRIAZOL3YL))4METHOXYBENZENE
3((3chlorobenzyl)sulfanyl)5(4methoxyphenyl)4methyl4H124triazole
3((3CHLOROPHENYL)METHYLSULFANYL)5(4METHOXYPHENYL)4METHYL124TRIAZOLE
CN1C(=NN=C1SCC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)OC
InChI=1SC17H16ClN3OSc12116(136815(222)9713)192017(21)23111243514(18)1012h310H11H212H3
MFCD07057117
ZINC000006147917
ZINC06147917
ZINC6147917

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Available files

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