Vitas-M small molecule compound

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

Catalog ID
STK149332
SMILES O=C(N1CCOCC1)CSc1nnc(n1C)c1ccc(cc1)C(C)(C)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 C19H26N4O2S MW 374.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O2S/c1-19(2,3)15-7-5-14(6-8-15)17-20-21-18(22(17)4)26-13-16(24)23-9-11-25-12-10-23/h5-8H,9-13H2,1-4H3
InChIKey
KMCKPRMPSMMCRV-UHFFFAOYSA-N
Synonyms
313400-75-8
2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)1morpholinoethanone
2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
2((5(4TERTBUTYLPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(MORPHOLIN4YL)ETHANONE
313400758
4(((5(4TERTBUTYLPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)MORPHOLINE
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)N3CCOCC3
InChI=1SC19H26N4O2Sc119(23)157514(6815)17202118(22(17)4)261316(24)2391125121023h58H913H214H3
MFCD01234052
MORPHOLINE4(((5(4(11DIMETHYLETHYL)PHENYL)4METHYL4H124TRIAZOL3YL)THIO)ACETYL)
ZINC000001517794
ZINC01517794
ZINC1517794

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Available files

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