Vitas-M small molecule compound

2-({4-ethyl-5-[(2-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(morpholin-4-yl)ethanone

Catalog ID
STK497855
SMILES CCn1c(SCC(=O)N2CCOCC2)nnc1COc1ccccc1C

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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 C18H24N4O3S MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4O3S/c1-3-22-16(12-25-15-7-5-4-6-14(15)2)19-20-18(22)26-13-17(23)21-8-10-24-11-9-21/h4-7H,3,8-13H2,1-2H3
InChIKey
UNPGJHRECPYNMS-UHFFFAOYSA-N
Synonyms

2((4ETHYL5((2METHYLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
2((4ethyl5((2methylphenoxy)methyl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
CCN1C(=NN=C1SCC(=O)N2CCOCC2)COC3=CC=CC=C3C
InChI=1SC18H24N4O3Sc132216(122515754614(15)2)192018(22)261317(23)218102411921h47H3813H212H3
MFCD03429416
ZINC000000904829
ZINC00904829
ZINC904829

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Available files

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