Vitas-M small molecule compound
3-[(2E)-2-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}hydrazinyl]-5H-[1,2,4]triazino[5,6-b]indole
Catalog ID
STK587586
SMILES COc1cc(ccc1c1ccc(o1)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1)[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 C21H15N7O4 MW 429.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N7O4/c1-31-18-10-12(28(29)30)6-8-15(18)17-9-7-13(32-17)11-22-26-21-24-20-19(25-27-21)14-4-2-3-5-16(14)23-20/h2-11H,1H3,(H2,23,24,26,27)/b22-11+InChIKey
CKOAFKQQLNQTCA-SSDVNMTOSA-NSynonyms
877801-42-8(E)3(2((5(2methoxy4nitrophenyl)furan2yl)methylene)hydrazinyl)5H(124)triazino(56b)indole
3((2E)2((5(2methoxy4nitrophenyl)furan2yl)methylidene)hydrazinyl)5H(124)triazino(56b)indole
877801428
COC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=NNC3=NC4=C(C5=CC=CC=C5N4)N=N3
COc1cc(ccc1c1ccc(o1)C=NNc1nnc2c(n1)(nH)c1c2cccc1)(N+)(=O)(O)
InChI=1SC21H15N7O4c131181012(28(29)30)6815(18)179713(3217)11222621242019(252721)14423516(14)2320h211H1H3(H223242627)b2211+
MFCD05704124
N((E)(5(2methoxy4nitrophenyl)furan2yl)methylideneamino)5H(124)triazino(56b)indol3amine
ZINC000013592127
ZINC38178017
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