Vitas-M small molecule compound

3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-5-(2-fluorophenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL340688
SMILES Nn1c(SCc2nc3c([nH]2)cccc3)nnc1c1ccccc1F

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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 C16H13FN6S MW 340.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13FN6S/c17-11-6-2-1-5-10(11)15-21-22-16(23(15)18)24-9-14-19-12-7-3-4-8-13(12)20-14/h1-8H,9,18H2,(H,19,20)
InChIKey
NIWYQEBELGWPBG-UHFFFAOYSA-N
Synonyms
577982-22-0
3(((1Hbenzo(d)imidazol2yl)methyl)thio)5(2fluorophenyl)4H124triazol4amine
3((1Hbenzimidazol2ylmethyl)sulfanyl)5(2fluorophenyl)4H124triazol4amine
3(1HBENZIMIDAZOL2YLMETHYLSULFANYL)5(2FLUOROPHENYL)124TRIAZOL4AMINE
5(BENZIMIDAZOL2YLMETHYLTHIO)3(2FLUOROPHENYL)124TRIAZOLE4YLAMINE
577982220
C1=CC=C(C(=C1)C2=NN=C(N2N)SCC3=NC4=CC=CC=C4N3)F
InChI=1SC16H13FN6Sc1711621510(11)15212216(23(15)18)249141912734813(12)2014h18H918H2(H1920)
MFCD04021603
Nn1c(SCc2nc3c((nH)2)cccc3)nnc1c1ccccc1F
ZINC000005026677
ZINC05026677
ZINC5026677

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Available files

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