Vitas-M small molecule compound

N-(4-methoxybenzyl)-3-[(4-methylphenyl)sulfonyl]thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidin-5-amine

Catalog ID
STL192802
SMILES COc1ccc(cc1)CNc1nc2n(c3c1scc3)nnc2S(=O)(=O)c1ccc(cc1)C

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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 C22H19N5O3S2 MW 465.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O3S2/c1-14-3-9-17(10-4-14)32(28,29)22-21-24-20(19-18(11-12-31-19)27(21)26-25-22)23-13-15-5-7-16(30-2)8-6-15/h3-12H,13H2,1-2H3,(H,23,24)
InChIKey
VIKICWFVIUDRTN-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=C(N3N=N2)C=CS4)NCC5=CC=C(C=C5)OC
InChI=1SC22H19N5O3S2c1143917(10414)32(2829)22212420(1918(11123119)27(21)262522)2313155716(302)8615h312H13H212H3(H2324)
MFCD14898756
N(4methoxybenzyl)3((4methylphenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidin5amine
ZINC000009116903
ZINC9116903

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Available files

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