Vitas-M small molecule compound
3-{5-[(Z)-(5-oxo-1-propyl-2-thioxoimidazolidin-4-ylidene)methyl]furan-2-yl}benzoic acid
Catalog ID
STK107533
SMILES CCCN1C(=S)N/C(=C\c2ccc(o2)c2cccc(c2)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 C18H16N2O4S MW 356.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O4S/c1-2-8-20-16(21)14(19-18(20)25)10-13-6-7-15(24-13)11-4-3-5-12(9-11)17(22)23/h3-7,9-10H,2,8H2,1H3,(H,19,25)(H,22,23)/b14-10-InChIKey
KXFYOCKIQJYZMF-UVTDQMKNSA-NSynonyms
3(5((Z)(5OXO1PROPYL2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)BENZOICACID
3(5((Z)(5OXO1PROPYL2THIOXOIMIDAZOLIDIN4YLIDENE)METHYL)FURAN2YL)BENZOICACID
CCCN1C(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)O)NC1=S
CCCN1C(=S)NC(=Cc2ccc(o2)c2cccc(c2)C(=O)O)C1=O
InChI=1SC18H16N2O4Sc1282016(21)14(1918(20)25)10136715(2413)1143512(911)17(22)23h37910H28H21H3(H1925)(H2223)b1410
MFCD04086871
ZINC000003667737
ZINC3667737
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