Vitas-M small molecule compound

2-chloro-4-(5-{(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid

Catalog ID
STK020478
SMILES Cc1cccc(c1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)/C1=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 C23H15ClN2O6 MW 450.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClN2O6/c1-12-3-2-4-14(9-12)26-21(28)17(20(27)25-23(26)31)11-15-6-8-19(32-15)13-5-7-16(22(29)30)18(24)10-13/h2-11H,1H3,(H,29,30)(H,25,27,31)/b17-11-
InChIKey
YNFJTHRUFFSVBU-BOPFTXTBSA-N
Synonyms
340307-20-2
(Z)2chloro4(5((246trioxo1(mtolyl)tetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
2CHLORO4(5((1(3METHYLPHENYL)246TRIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)2FURYL)BENZOICACID
2CHLORO4(5((Z)(1(3METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2CHLORO4(5((Z)(1(3METHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
2CHLORO4(5((Z)(4HYDROXY1(3METHYLPHENYL)26DIOXO16DIHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
340307202
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)C(=O)O)Cl)C(=O)NC2=O
Cc1cccc(c1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)C1=O
InChI=1SC23H15ClN2O6c11232414(912)2621(28)17(20(27)2523(26)31)11156819(3215)135716(22(29)30)18(24)1013h211H1H3(H2930)(H252731)b1711
MFCD02107504
STK020478
ZINC17058360

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Available files

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