Vitas-M small molecule compound
2-({4-benzyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-phenylacetamide
Catalog ID
STL186032
SMILES O=C(Nc1ccccc1)CSc1nnc(n1Cc1ccccc1)COc1ccc(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 C25H24N4O2S MW 444.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2S/c1-19-12-14-22(15-13-19)31-17-23-27-28-25(29(23)16-20-8-4-2-5-9-20)32-18-24(30)26-21-10-6-3-7-11-21/h2-15H,16-18H2,1H3,(H,26,30)InChIKey
XFTIRRWXNOKSBH-UHFFFAOYSA-NSynonyms
2((4BENZYL5((4METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)NPHENYLACETAMIDE
2((4benzyl5((4methylphenoxy)methyl)4H124triazol3yl)sulfanyl)Nphenylacetamide
2(5((4METHYLPHENOXY)METHYL)4BENZYL(124TRIAZOL3YLTHIO))NPHENYLACETAMIDE
CC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCC(=O)NC4=CC=CC=C4
InChI=1SC25H24N4O2Sc119121422(151319)311723272825(29(23)16208425920)321824(30)2621106371121h215H1618H21H3(H2630)
MFCD02742020
ZINC000000898599
ZINC00898599
ZINC898599
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