Vitas-M small molecule compound

3-(4-ethoxyphenyl)-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-4-amine

Catalog ID
STL338888
SMILES CCOc1ccc(cc1)c1nnc(n1N)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 C18H20N4OS MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4OS/c1-3-23-16-10-8-14(9-11-16)17-20-21-18(22(17)19)24-12-15-7-5-4-6-13(15)2/h4-11H,3,12,19H2,1-2H3
InChIKey
NVDHHZTVFUVFRE-UHFFFAOYSA-N
Synonyms
678540-64-2
3(4ethoxyphenyl)5((2methylbenzyl)sulfanyl)4H124triazol4amine
3(4ethoxyphenyl)5((2methylbenzyl)thio)4H124triazol4amine
3(4ETHOXYPHENYL)5((2METHYLPHENYL)METHYLSULFANYL)124TRIAZOL4AMINE
5(4ETHOXYPHENYL)3((2METHYLPHENYL)METHYLTHIO)124TRIAZOLE4YLAMINE
678540642
CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=CC=C3C
InChI=1SC18H20N4OSc13231610814(91116)17202118(22(17)19)241215754613(15)2h411H31219H212H3
MFCD04007008
ZINC000005099911
ZINC05099911
ZINC5099911

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.