Vitas-M small molecule compound

2-{[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide

Catalog ID
STK283990
SMILES O=C(Nc1cccc2c1cccc2)CSc1nnc(n1C)CN1CCOCC1

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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 C20H23N5O2S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O2S/c1-24-18(13-25-9-11-27-12-10-25)22-23-20(24)28-14-19(26)21-17-8-4-6-15-5-2-3-7-16(15)17/h2-8H,9-14H2,1H3,(H,21,26)
InChIKey
LRHYTULRPVAFJW-UHFFFAOYSA-N
Synonyms

2((4METHYL5(MORPHOLIN4YLMETHYL)124TRIAZOL3YL)SULFANYL)NNAPHTHALEN1YLACETAMIDE
2((4METHYL5(MORPHOLIN4YLMETHYL)4H124TRIAZOL3YL)SULFANYL)N(NAPHTHALEN1YL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)CN4CCOCC4
InChI=1SC20H23N5O2Sc12418(132591127121025)222320(24)281419(26)211784615523716(15)17h28H914H21H3(H2126)
MFCD04343034
ZINC000019799114
ZINC19799114

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Available files

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