Vitas-M small molecule compound

3-benzyl-5-(benzylsulfanyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazole

Catalog ID
STL375673
SMILES CCOc1ccc(cc1)n1c(nnc1SCc1ccccc1)Cc1ccccc1

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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 C24H23N3OS MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3OS/c1-2-28-22-15-13-21(14-16-22)27-23(17-19-9-5-3-6-10-19)25-26-24(27)29-18-20-11-7-4-8-12-20/h3-16H,2,17-18H2,1H3
InChIKey
YQJIVRWGWKERJQ-UHFFFAOYSA-N
Synonyms

3benzyl5(benzylsulfanyl)4(4ethoxyphenyl)4H124triazole
3BENZYL5BENZYLSULFANYL4(4ETHOXYPHENYL)124TRIAZOLE
4(3BENZYL5(BENZYLSULFANYL)4H124TRIAZOL4YL)PHENYLETHYLETHER
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)CC4=CC=CC=C4
InChI=1SC24H23N3OSc122822151321(141622)2723(171995361019)252624(27)291820117481220h316H21718H21H3
MFCD03862183
ZINC000002128734
ZINC02128734
ZINC2128734

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Available files

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