Vitas-M small molecule compound

2-{[4-(3-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone

Catalog ID
STL354183
SMILES Cc1cccc(c1)n1c(SCC(=O)N2CCOCC2)nnc1c1ccncc1

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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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-15-3-2-4-17(13-15)25-19(16-5-7-21-8-6-16)22-23-20(25)28-14-18(26)24-9-11-27-12-10-24/h2-8,13H,9-12,14H2,1H3
InChIKey
VCMMRKGLJQGFHF-UHFFFAOYSA-N
Synonyms

2((4(3methylphenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2((4(3METHYLPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
4(((4(3METHYLPHENYL)5(4PYRIDINYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)MORPHOLINE
CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)N3CCOCC3)C4=CC=NC=C4
InChI=1SC20H21N5O2Sc11532417(1315)2519(1657218616)222320(25)281418(26)2491127121024h2813H91214H21H3
MFCD03862171
ZINC000000664279
ZINC00664279
ZINC664279

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Available files

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