Vitas-M small molecule compound
2-{5-[(Z)-(1-methyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STL055425
SMILES CN1C(=NC(=O)/C(=C/c2ccc(o2)c2ccccc2C(=O)O)/C1=O)S
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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 C17H12N2O5S MW 356.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O5S/c1-19-15(21)12(14(20)18-17(19)25)8-9-6-7-13(24-9)10-4-2-3-5-11(10)16(22)23/h2-8H,1H3,(H,22,23)(H,18,20,25)/b12-8-InChIKey
MNEIOLMUJVJYMT-WQLSENKSSA-NSynonyms
713093-17-52(5((Z)(1methyl46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)furan2yl)benzoicacid
2(5((Z)(1METHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
713093175
CN1C(=NC(=O)C(=Cc2ccc(o2)c2ccccc2C(=O)O)C1=O)S
InChI=1SC17H12N2O5Sc11915(21)12(14(20)1817(19)25)896713(249)10423511(10)16(22)23h28H1H3(H2223)(H182025)b128
MFCD05725577
ZINC000009286870
ZINC9286870
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