Vitas-M small molecule compound
2,3-dimethoxy-6-{(E)-[2-(5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]methyl}benzoic acid
Catalog ID
STL321042
SMILES COc1c(OC)ccc(c1C(=O)O)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1
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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 C19H16N6O4 MW 392.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N6O4/c1-28-13-8-7-10(14(18(26)27)16(13)29-2)9-20-24-19-22-17-15(23-25-19)11-5-3-4-6-12(11)21-17/h3-9H,1-2H3,(H,26,27)(H2,21,22,24,25)/b20-9+InChIKey
IOANHMBLSMAYNZ-AWQFTUOYSA-NSynonyms
23dimethoxy6((E)(2(5H(124)triazino(56b)indol3yl)hydrazinylidene)methyl)benzoicacid
23dimethoxy6((E)(5H(124)triazino(56b)indol3ylhydrazinylidene)methyl)benzoicacid
6((2(5H(124)triazino(56b)indol3yl)hydrazono)methyl)23dimethoxybenzoicacid
COC1=C(C(=C(C=C1)C=NNC2=NC3=C(C4=CC=CC=C4N3)N=N2)C(=O)O)OC
COc1c(OC)ccc(c1C(=O)O)C=NNc1nnc2c(n1)(nH)c1c2cccc1
InChI=1SC19H16N6O4c128138710(14(18(26)27)16(13)292)9202419221715(232519)11534612(11)2117h39H12H3(H2627)(H221222425)b209+
MFCD01550853
ZINC000004728963
ZINC33941427
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