Vitas-M small molecule compound

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

Catalog ID
STK187673
SMILES Cc1cccc(c1)C(=O)n1nc(nc1NCc1cccs1)NCc1cccs1

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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 C20H19N5OS2 MW 409.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5OS2/c1-14-5-2-6-15(11-14)18(26)25-20(22-13-17-8-4-10-28-17)23-19(24-25)21-12-16-7-3-9-27-16/h2-11H,12-13H2,1H3,(H2,21,22,23,24)
InChIKey
CSGSRFOTHWCORS-UHFFFAOYSA-N
Synonyms

(35BIS((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)(3METHYLPHENYL)METHANONE
(35BIS(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)(3METHYLPHENYL)METHANONE
CC1=CC=CC(=C1)C(=O)N2C(=NC(=N2)NCC3=CC=CS3)NCC4=CC=CS4
InChI=1SC20H19N5OS2c11452615(1114)18(26)2520(22131784102817)2319(2425)2112167392716h211H1213H21H3(H221222324)
MFCD06664636
ZINC000004723831
ZINC04723831
ZINC4723831

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Available files

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