Vitas-M small molecule compound

5-(4-chloro-3-nitrophenyl)-N-{4-[4-(pentafluorophenyl)piperazin-1-yl]phenyl}furan-2-carboxamide

Catalog ID
STK344628
SMILES O=C(c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)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 C27H18ClF5N4O4 MW 592.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClF5N4O4/c28-17-6-1-14(13-18(17)37(39)40)19-7-8-20(41-19)27(38)34-15-2-4-16(5-3-15)35-9-11-36(12-10-35)26-24(32)22(30)21(29)23(31)25(26)33/h1-8,13H,9-12H2,(H,34,38)
InChIKey
XZQUJNDZVQFEIW-UHFFFAOYSA-N
Synonyms

5(4chloro3nitrophenyl)N(4(4(23456pentafluorophenyl)piperazin1yl)phenyl)furan2carboxamide
5(4chloro3nitrophenyl)N(4(4(pentafluorophenyl)piperazin1yl)phenyl)furan2carboxamide
C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C5=C(C(=C(C(=C5F)F)F)F)F
InChI=1SC27H18ClF5N4O4c28176114(1318(17)37(39)40)197820(4119)27(38)34152416(5315)3591136(121035)2624(32)22(30)21(29)23(31)25(26)33h1813H912H2(H3438)
MFCD07037463
O=C(c1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))Cl)Nc1ccc(cc1)N1CCN(CC1)c1c(F)c(F)c(c(c1F)F)F
ZINC000100167442
ZINC100167442

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Available files

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