Vitas-M small molecule compound

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

Catalog ID
STL338969
SMILES CCOc1cccc(c1)c1nnc(n1N)SCc1ccc(cc1)Br

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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 C17H17BrN4OS MW 405.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN4OS/c1-2-23-15-5-3-4-13(10-15)16-20-21-17(22(16)19)24-11-12-6-8-14(18)9-7-12/h3-10H,2,11,19H2,1H3
InChIKey
PLOXVVGCOLXDLH-UHFFFAOYSA-N
Synonyms
679419-44-4
3((4bromobenzyl)sulfanyl)5(3ethoxyphenyl)4H124triazol4amine
3((4bromobenzyl)thio)5(3ethoxyphenyl)4H124triazol4amine
3((4BROMOPHENYL)METHYLSULFANYL)5(3ETHOXYPHENYL)124TRIAZOL4AMINE
3((4BROMOPHENYL)METHYLTHIO)5(3ETHOXYPHENYL)124TRIAZOLE4YLAMINE
679419444
CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)Br
InChI=1SC17H17BrN4OSc12231553413(1015)16202117(22(16)19)2411126814(18)9712h310H21119H21H3
MFCD04007727
ZINC000002265108
ZINC02265108
ZINC2265108

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Available files

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