Vitas-M small molecule compound

N-(2-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK589411
SMILES COc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

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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 C22H20N6O2S MW 432.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O2S/c1-15-7-9-16(10-8-15)28-21(18-13-23-11-12-24-18)26-27-22(28)31-14-20(29)25-17-5-3-4-6-19(17)30-2/h3-13H,14H2,1-2H3,(H,25,29)
InChIKey
RHWXCXCRWJSWNW-UHFFFAOYSA-N
Synonyms
896849-41-5
896849415
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3OC)C4=NC=CN=C4
InChI=1SC22H20N6O2Sc1157916(10815)2821(18132311122418)262722(28)311420(29)2517534619(17)302h313H14H212H3(H2529)
MFCD06602974
N(2methoxyphenyl)2((4(4methylphenyl)5(pyrazin2yl)4H124triazol3yl)sulfanyl)acetamide
N(2METHOXYPHENYL)2((4(4METHYLPHENYL)5PYRAZIN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2methoxyphenyl)2((5(pyrazin2yl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(2METHOXYPHENYL)2(4(4METHYLPHENYL)5PYRAZIN2YL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002236785
ZINC02236785
ZINC2236785

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Available files

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