methyl 3-[[2-(3-oxidanylidene-1H-isoindol-2-yl)-2-phenyl-ethanoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[2-(3-oxidanylidene-1H-isoindol-2-yl)-2-phenyl-ethanoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(1-oxoisoindolin-2-yl)-2-phenyl-acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-(3-oxo-1H-isoindol-2-yl)-2-phenylethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(1-ketoisoindolin-2-yl)-2-phenyl-acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C(C2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C(C2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H18N2O4S/c1-28-22(27)19-17(11-12-29-19)23-20(25)18(14-7-3-2-4-8-14)24-13-15-9-5-6-10-16(15)21(24)26/h2-12,18H,13H2,1H3,(H,23,25)