methyl 5-[[2-oxidanylidene-2-(2-phenylindolizin-3-yl)ethanoyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 5-[[2-oxidanylidene-2-(2-phenylindolizin-3-yl)ethanoyl]amino]thiophene-3-carboxylate Openeye Name: methyl 5-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-[[1,2-dioxo-2-(2-phenyl-3-indolizinyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-[[2-keto-2-(2-phenylindolizin-3-yl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H16N2O4S MolecularWeight: 404.43844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1)NC(=O)C(=O)C2=C(C=C3N2C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CSC(=C1)NC(=O)C(=O)C2=C(C=C3N2C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H16N2O4S/c1-28-22(27)15-11-18(29-13-15)23-21(26)20(25)19-17(14-7-3-2-4-8-14)12-16-9-5-6-10-24(16)19/h2-13H,1H3,(H,23,26)