Vitas-M small molecule compound

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

Catalog ID
STL339073
SMILES Cc1cccc(c1)c1nnc(n1N)SCc1nc2c([nH]1)cccc2

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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 C17H16N6S MW 336.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6S/c1-11-5-4-6-12(9-11)16-21-22-17(23(16)18)24-10-15-19-13-7-2-3-8-14(13)20-15/h2-9H,10,18H2,1H3,(H,19,20)
InChIKey
MDYSOUSQLNWZMX-UHFFFAOYSA-N
Synonyms
676590-15-1
3(((1Hbenzo(d)imidazol2yl)methyl)thio)5(mtolyl)4H124triazol4amine
3((1Hbenzimidazol2ylmethyl)sulfanyl)5(3methylphenyl)4H124triazol4amine
3(1HBENZIMIDAZOL2YLMETHYLSULFANYL)5(3METHYLPHENYL)124TRIAZOL4AMINE
3(BENZIMIDAZOL2YLMETHYLTHIO)5(3METHYLPHENYL)124TRIAZOLE4YLAMINE
676590151
CC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=NC4=CC=CC=C4N3
Cc1cccc(c1)c1nnc(n1N)SCc1nc2c((nH)1)cccc2
InChI=1SC17H16N6Sc11154612(911)16212217(23(16)18)2410151913723814(13)2015h29H1018H21H3(H1920)
MFCD04008443
ZINC000000523912
ZINC00523912
ZINC523912

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Available files

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