Vitas-M small molecule compound

2-[5-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK235980
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)OC)nnc1CC(=O)Nc1cccc(c1)C(F)(F)F

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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 C23H21F3N4O3S MW 490.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F3N4O3S/c1-3-11-30-20(13-21(32)27-17-6-4-5-16(12-17)23(24,25)26)28-29-22(30)34-14-19(31)15-7-9-18(33-2)10-8-15/h3-10,12H,1,11,13-14H2,2H3,(H,27,32)
InChIKey
IOMQGYKFSVGZHV-UHFFFAOYSA-N
Synonyms

2(5((2(4methoxyphenyl)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)N(3(trifluoromethyl)phenyl)acetamide
2(5(2(4METHOXYPHENYL)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC23H21F3N4O3Sc13113020(1321(32)271764516(1217)23(2425)26)282922(30)341419(31)157918(332)10815h31012H1111314H22H3(H2732)
MFCD06007317
ZINC000001066427
ZINC01066427
ZINC1066427

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Available files

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