Vitas-M small molecule compound
ethyl 1-benzyl-2-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Catalog ID
STL234393
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])n(c2c1nc1ccccc1n2)Cc1ccccc1
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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 C29H23N5O5 MW 521.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O5/c1-2-39-29(36)25-26-28(31-23-14-7-6-13-22(23)30-26)33(18-20-9-4-3-5-10-20)27(25)32-24(35)16-15-19-11-8-12-21(17-19)34(37)38/h3-17H,2,18H2,1H3,(H,32,35)/b16-15+InChIKey
FGKCEQYCSRVBAQ-FOCLMDBBSA-NSynonyms
373378-08-6(E)ethyl1benzyl2(3(3nitrophenyl)acrylamido)1Hpyrrolo(23b)quinoxaline3carboxylate
373378086
CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC4=CC=CC=C4)NC(=O)C=CC5=CC(=CC=C5)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))n(c2c1nc1ccccc1n2)Cc1ccccc1
ethyl1benzyl2(((2E)3(3nitrophenyl)prop2enoyl)amino)1Hpyrrolo(23b)quinoxaline3carboxylate
ETHYL1BENZYL2(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
InChI=1SC29H23N5O5c123929(36)252628(312314761322(23)3026)33(182094351020)27(25)3224(35)1615191181221(1719)34(37)38h317H218H21H3(H3235)b1615+
MFCD01947533
ZINC000002280895
ZINC02280895
ZINC2280895
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