Vitas-M small molecule compound

3-(4-bromophenyl)-6-iodo-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one

Catalog ID
STL036314
SMILES Brc1ccc(cc1)n1c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)cc(cc2)I

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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 C22H13BrIN3O3 MW 574.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13BrIN3O3/c23-15-4-9-17(10-5-15)26-21(12-3-14-1-7-18(8-2-14)27(29)30)25-20-11-6-16(24)13-19(20)22(26)28/h1-13H/b12-3+
InChIKey
HULWKLLCTRPRLX-KGVSQERTSA-N
Synonyms

(E)3(4bromophenyl)6iodo2(4nitrostyryl)quinazolin4(3H)one
3(4bromophenyl)6iodo2((E)2(4nitrophenyl)ethenyl)quinazolin4(3H)one
3(4BROMOPHENYL)6IODO2((E)2(4NITROPHENYL)ETHENYL)QUINAZOLIN4ONE
Brc1ccc(cc1)n1c(C=Cc2ccc(cc2)(N+)(=O)(O))nc2c(c1=O)cc(cc2)I
C1=CC(=CC=C1C=CC2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)Br)(N+)(=O)(O)
InChI=1SC22H13BrIN3O3c23154917(10515)2621(123141718(8214)27(29)30)252011616(24)1319(20)22(26)28h113Hb123+
MFCD03297762
ZINC000101086406
ZINC101086406

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Available files

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