Vitas-M small molecule compound

3-[(3-chlorobenzyl)sulfanyl]-5-(4-methoxyphenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL302925
SMILES COc1ccc(cc1)c1nnc(n1N)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 C16H15ClN4OS MW 346.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4OS/c1-22-14-7-5-12(6-8-14)15-19-20-16(21(15)18)23-10-11-3-2-4-13(17)9-11/h2-9H,10,18H2,1H3
InChIKey
KBFSKCKCJZKBFZ-UHFFFAOYSA-N
Synonyms
678553-76-9
3((3chlorobenzyl)sulfanyl)5(4methoxyphenyl)4H124triazol4amine
3((3chlorobenzyl)thio)5(4methoxyphenyl)4H124triazol4amine
3((3CHLOROPHENYL)METHYLSULFANYL)5(4METHOXYPHENYL)124TRIAZOL4AMINE
3((3CHLOROPHENYL)METHYLTHIO)5(4METHOXYPHENYL)124TRIAZOLE4YLAMINE
678553769
COC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Cl
InChI=1SC16H15ClN4OSc122147512(6814)15192016(21(15)18)23101132413(17)911h29H1018H21H3
MFCD04008625
ZINC000000523983
ZINC00523983
ZINC523983

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Available files

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