Vitas-M small molecule compound

(5Z)-5-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-1-(3,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK170418
SMILES Clc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)C

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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 C23H16ClN3O6 MW 465.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClN3O6/c1-12-3-5-15(9-13(12)2)26-22(29)18(21(28)25-23(26)30)11-16-6-8-20(33-16)17-7-4-14(24)10-19(17)27(31)32/h3-11H,1-2H3,(H,25,28,30)/b18-11-
InChIKey
RCAWZUSJBOESMI-WQRHYEAKSA-N
Synonyms
347387-99-9
(5Z)5((5(4CHLORO2NITROPHENYL)FURAN2YL)METHYLIDENE)1(34DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5((5(4CHLORO2NITROPHENYL)FURAN2YL)METHYLIDENE)1(34DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((5(4CHLORO2NITROPHENYL)FURAN2YL)METHYLIDENE)3(34DIMETHYLPHENYL)6HYDROXYPYRIMIDINE24(3H5H)DIONE
(Z)5((5(4chloro2nitrophenyl)furan2yl)methylene)1(34dimethylphenyl)pyrimidine246(1H3H5H)trione
347387999
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)Cl)(N+)(=O)(O))C(=O)NC2=O)C
Clc1ccc(c(c1)(N+)(=O)(O))c1ccc(o1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)C
InChI=1SC23H16ClN3O6c1123515(913(12)2)2622(29)18(21(28)2523(26)30)11166820(3316)177414(24)1019(17)27(31)32h311H12H3(H252830)b1811
MFCD02628965
ZINC09891797
ZINC9891797

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Available files

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