Vitas-M small molecule compound
4-[(2-{(Z)-[1-(2-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzoic acid
Catalog ID
STK192588
SMILES O=C1NC(=S)N(C(=O)/C/1=C\c1ccccc1OCc1ccc(cc1)C(=O)O)c1ccccc1F
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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 C25H17FN2O5S MW 476.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17FN2O5S/c26-19-6-2-3-7-20(19)28-23(30)18(22(29)27-25(28)34)13-17-5-1-4-8-21(17)33-14-15-9-11-16(12-10-15)24(31)32/h1-13H,14H2,(H,31,32)(H,27,29,34)/b18-13-InChIKey
QFUQSGPPIDPSAE-AQTBWJFISA-NSynonyms
(Z)4((2((1(2fluorophenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)methyl)benzoicacid
4((2((Z)(1(2FLUOROPHENYL)46DIOXO2SULFANYL16DIHYDROPYRIMIDIN5(4H)YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((2((Z)(1(2FLUOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
4((2((Z)(1(2FLUOROPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)METHYL)BENZOICACID
C1=CC=C(C(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3F)OCC4=CC=C(C=C4)C(=O)O
InChI=1SC25H17FN2O5Sc2619623720(19)2823(30)18(22(29)2725(28)34)1317514821(17)33141591116(121015)24(31)32h113H14H2(H3132)(H272934)b1813
MFCD02905069
O=C1NC(=S)N(C(=O)C1=Cc1ccccc1OCc1ccc(cc1)C(=O)O)c1ccccc1F
ZINC1186404
Check stock
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Check stock on Vitas-MAvailable files
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