Vitas-M small molecule compound
2-chloro-5-(5-{(Z)-[1-(2-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STL388349
SMILES O=C1NC(=S)N(C(=O)/C/1=C\c1ccc(o1)c1ccc(c(c1)C(=O)O)Cl)c1ccccc1Cl
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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 C22H12Cl2N2O5S MW 487.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12Cl2N2O5S/c23-15-7-5-11(9-13(15)21(29)30)18-8-6-12(31-18)10-14-19(27)25-22(32)26(20(14)28)17-4-2-1-3-16(17)24/h1-10H,(H,29,30)(H,25,27,32)/b14-10-InChIKey
SISAINPNXKETAI-UVTDQMKNSA-NSynonyms
2CHLORO5(5((1(2CHLOROPHENYL)46DIOXO2THIOXOTETRAHYDRO5(2H)PYRIMIDINYLIDENE)METHYL)2FURYL)BENZOICACID
2CHLORO5(5((Z)(1(2CHLOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2chloro5(5((Z)(1(2chlorophenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoicacid
C1=CC=C(C(=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)C(=O)NC2=S)Cl
InChI=1SC22H12Cl2N2O5Sc23157511(913(15)21(29)30)188612(3118)101419(27)2522(32)26(20(14)28)17421316(17)24h110H(H2930)(H252732)b1410
MFCD04090423
O=C1NC(=S)N(C(=O)C1=Cc1ccc(o1)c1ccc(c(c1)C(=O)O)Cl)c1ccccc1Cl
ZINC000008451884
ZINC8451884
Check stock
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