Vitas-M small molecule compound

4-tert-butyl-N-{4-[4-(pentafluorophenyl)piperazin-1-yl]phenyl}benzamide

Catalog ID
STK254259
SMILES O=C(c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)N1CCN(CC1)c1c(F)c(F)c(c(c1F)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 C27H26F5N3O MW 503.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F5N3O/c1-27(2,3)17-6-4-16(5-7-17)26(36)33-18-8-10-19(11-9-18)34-12-14-35(15-13-34)25-23(31)21(29)20(28)22(30)24(25)32/h4-11H,12-15H2,1-3H3,(H,33,36)
InChIKey
UOCISAHJDVONKA-UHFFFAOYSA-N
Synonyms

4tertbutylN(4(4(23456pentafluorophenyl)piperazin1yl)phenyl)benzamide
4tertbutylN(4(4(pentafluorophenyl)piperazin1yl)phenyl)benzamide
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC27H26F5N3Oc127(23)176416(5717)26(36)331881019(11918)34121435(151334)2523(31)21(29)20(28)22(30)24(25)32h411H1215H213H3(H3336)
MFCD03836115
ZINC000004122024
ZINC04122024
ZINC4122024

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Available files

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