Vitas-M small molecule compound
N-[2-methoxy-4-({(2E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)phenyl]-1-benzofuran-2-carboxamide
Catalog ID
STK209291
SMILES COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=O)/C=C/c1ccc(o1)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 C29H21N3O7 MW 523.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N3O7/c1-37-26-17-19(10-13-22(26)31-29(34)27-16-18-6-2-5-9-24(18)39-27)30-28(33)15-12-20-11-14-25(38-20)21-7-3-4-8-23(21)32(35)36/h2-17H,1H3,(H,30,33)(H,31,34)/b15-12+InChIKey
OTTZDXDETZDNHQ-NTCAYCPXSA-NSynonyms
COC1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3(N+)(=O)(O))NC(=O)C4=CC5=CC=CC=C5O4
COc1cc(ccc1NC(=O)c1cc2c(o1)cccc2)NC(=O)C=Cc1ccc(o1)c1ccccc1(N+)(=O)(O)
InChI=1SC29H21N3O7c137261719(101322(26)3129(34)271618625924(18)3927)3028(33)151220111425(3820)21734823(21)32(35)36h217H1H3(H3033)(H3134)b1512+
MFCD02770238
N(2METHOXY4(((2E)3(5(2NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)PHENYL)1BENZOFURAN2CARBOXAMIDE
N(2methoxy4(((E)3(5(2nitrophenyl)furan2yl)prop2enoyl)amino)phenyl)1benzofuran2carboxamide
ZINC000101147657
ZINC101147657
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