Vitas-M small molecule compound

dimethyl 3-methyl-5-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate

Catalog ID
STK421840
SMILES COC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc(c1C)C(=O)OC

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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 C18H16N2O7S MW 404.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O7S/c1-10-14(17(22)26-2)16(28-15(10)18(23)27-3)19-13(21)8-7-11-5-4-6-12(9-11)20(24)25/h4-9H,1-3H3,(H,19,21)/b8-7+
InChIKey
GOEKMFPWDNLBET-BQYQJAHWSA-N
Synonyms
353470-02-7
353470027
CC1=C(SC(=C1C(=O)OC)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))sc(c1C)C(=O)OC
dimethyl3methyl5(((2E)3(3nitrophenyl)prop2enoyl)amino)thiophene24dicarboxylate
DIMETHYL3METHYL5(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)THIOPHENE24DICARBOXYLATE
DIMETHYL5((3(3NITROPHENYL)ACRYLOYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
InChI=1SC18H16N2O7Sc11014(17(22)262)16(2815(10)18(23)273)1913(21)871154612(911)20(24)25h49H13H3(H1921)b87+
MFCD01336313
ZINC000002081334
ZINC02081334
ZINC2081334

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Available files

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