Vitas-M small molecule compound

N-[3-(4-bromophenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide

Catalog ID
STK343674
SMILES Brc1ccc(cc1)Oc1cc(NC(=O)c2cc3n(n2)c(c2c(n3)c3ccccc3CC2)C(F)(F)F)cc(c1)[N+](=O)[O-]

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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 C28H17BrF3N5O4 MW 624.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H17BrF3N5O4/c29-16-6-8-19(9-7-16)41-20-12-17(11-18(13-20)37(39)40)33-27(38)23-14-24-34-25-21-4-2-1-3-15(21)5-10-22(25)26(28(30,31)32)36(24)35-23/h1-4,6-9,11-14H,5,10H2,(H,33,38)
InChIKey
VTPHGIANEOJUMM-UHFFFAOYSA-N
Synonyms
351521-21-6
351521216
Brc1ccc(cc1)Oc1cc(NC(=O)c2cc3n(n2)c(c2c(n3)c3ccccc3CC2)C(F)(F)F)cc(c1)(N+)(=O)(O)
C1CC2=C(N3C(=CC(=N3)C(=O)NC4=CC(=CC(=C4)OC5=CC=C(C=C5)Br)(N+)(=O)(O))N=C2C6=CC=CC=C61)C(F)(F)F
InChI=1SC28H17BrF3N5O4c29166819(9716)41201217(1118(1320)37(39)40)3327(38)231424342521421315(21)51022(25)26(28(3031)32)36(24)3523h14691114H510H2(H3338)
MFCD01528666
N(3(4BROMOPHENOXY)5NITROPHENYL)7(TRIFLUOROMETHYL)56DIHYDROBENZO(H)PYRAZOLO(51B)QUINAZOLINE10CARBOXAMIDE
N(5(4BROMOPHENOXY)3NITROPHENYL)(7(TRIFLUOROMETHYL)(568TRIHYDROBENZO(H)PYRAZOLO(51B)QUINAZOLIN10YL))CARBOXAMIDE
ZINC000097999458
ZINC97999458

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Available files

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