Vitas-M small molecule compound
3-[3-({imino[(2E)-2-(2-nitrobenzylidene)hydrazinyl]methyl}sulfanyl)-2,5-dioxopyrrolidin-1-yl]benzoic acid
Catalog ID
STK373366
SMILES N=C(SC1CC(=O)N(C1=O)c1cccc(c1)C(=O)O)N/N=C/c1ccccc1[N+](=O)[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 C19H15N5O6S MW 441.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O6S/c20-19(22-21-10-12-4-1-2-7-14(12)24(29)30)31-15-9-16(25)23(17(15)26)13-6-3-5-11(8-13)18(27)28/h1-8,10,15H,9H2,(H2,20,22)(H,27,28)/b21-10+InChIKey
YLKMXWHHMNGWCG-UFFVCSGVSA-NSynonyms
3(3((((1E)2(2NITROPHENYL)1AZAVINYL)AMINO)IMINOMETHYLTHIO)25DIOXOAZOLIDINYL)BENZOICACID
3(3((E)N((E)(2nitrophenyl)methylideneamino)carbamimidoyl)sulfanyl25dioxopyrrolidin1yl)benzoicacid
3(3((imino((2E)2(2nitrobenzylidene)hydrazinyl)methyl)sulfanyl)25dioxopyrrolidin1yl)benzoicacid
C1C(C(=O)N(C1=O)C2=CC=CC(=C2)C(=O)O)SC(=NN=CC3=CC=CC=C3(N+)(=O)(O))N
InChI=1SC19H15N5O6Sc2019(22211012412714(12)24(29)30)3115916(25)23(17(15)26)1363511(813)18(27)28h181015H9H2(H22022)(H2728)b2110+
MFCD00635328
N=C(SC1CC(=O)N(C1=O)c1cccc(c1)C(=O)O)NN=Cc1ccccc1(N+)(=O)(O)
ZINC000019285643
ZINC000100501176
Check stock
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