Vitas-M small molecule compound

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

Catalog ID
STK580517
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-18-11-13-20(14-12-18)29-23(16-32-21-8-4-3-5-9-21)27-28-25(29)33-17-24(30)26-19-7-6-10-22(15-19)31-2/h3-15H,16-17H2,1-2H3,(H,26,30)
InChIKey
FBNMICGXULPIRN-UHFFFAOYSA-N
Synonyms
896815-79-5
896815795
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)OC)COC4=CC=CC=C4
InChI=1SC25H24N4O3Sc118111320(141218)2923(1632218435921)272825(29)331724(30)2619761022(1519)312h315H1617H212H3(H2630)
MFCD06597005
N(3METHOXYPHENYL)2((4(4METHYLPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3methoxyphenyl)2((4(4methylphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetamide
N(3methoxyphenyl)2((5(phenoxymethyl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(3METHOXYPHENYL)2(4(4METHYLPHENYL)5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002206437
ZINC02206437
ZINC2206437

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Available files

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