Vitas-M small molecule compound

(3-methylphenyl){3-(pyridin-3-yl)-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}methanone

Catalog ID
STK211663
SMILES Cc1cccc(c1)C(=O)n1nc(nc1NCc1cccs1)c1cccnc1

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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 C20H17N5OS MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5OS/c1-14-5-2-6-15(11-14)19(26)25-20(22-13-17-8-4-10-27-17)23-18(24-25)16-7-3-9-21-12-16/h2-12H,13H2,1H3,(H,22,23,24)
InChIKey
YUDPPYFFAVRJRK-UHFFFAOYSA-N
Synonyms

(3METHYLPHENYL)(3(PYRIDIN3YL)5((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)METHANONE
(3METHYLPHENYL)(3PYRIDIN3YL5(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)METHANONE
CC1=CC=CC(=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CS4
InChI=1SC20H17N5OSc11452615(1114)19(26)2520(22131784102717)2318(2425)16739211216h212H13H21H3(H222324)
MFCD07393298
ZINC000004777309
ZINC04777309
ZINC4777309

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Available files

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