ethyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(1,3-dioxoisoindolin-2-yl)butanoylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,3-dioxoisoindol-2-yl)butanoylamino]-5-methylthiophene-3-carboxylate Traditional Name: 5-methyl-2-(2-phthalimidobutanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(S1)C)C(=O)OCC)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(S1)C)C(=O)OCC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O5S/c1-4-15(22-18(24)12-8-6-7-9-13(12)19(22)25)16(23)21-17-14(10-11(3)28-17)20(26)27-5-2/h6-10,15H,4-5H2,1-3H3,(H,21,23)