Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-diethylacetamide

Catalog ID
STK031393
SMILES COc1ccc(cc1)n1c(SCC(=O)N(CC)CC)nnc1c1ccc(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 C25H32N4O2S MW 452.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O2S/c1-7-28(8-2)22(30)17-32-24-27-26-23(18-9-11-19(12-10-18)25(3,4)5)29(24)20-13-15-21(31-6)16-14-20/h9-16H,7-8,17H2,1-6H3
InChIKey
NRAUMUNYICEKBX-UHFFFAOYSA-N
Synonyms
499103-30-9
2((5(4(tertbutyl)phenyl)4(4methoxyphenyl)4H124triazol3yl)thio)NNdiethylacetamide
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)NNDIETHYLACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)NNDIETHYLACETAMIDE
2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))NNDIETHYLACETAMIDE
499103309
CCN(CC)C(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC=C(C=C3)C(C)(C)C
COc1ccc(cc1)n1c(SCC(=O)N(CC)CC)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC25H32N4O2Sc1728(82)22(30)173224272623(1891119(121018)25(34)5)29(24)20131521(316)161420h916H7817H216H3
MFCD03224017
STK031393
ZINC000001293987
ZINC01293987
ZINC1293987

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Available files

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