[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O5S/c1-13(18(24)21-12-14-6-5-11-28-14)27-17(23)9-4-10-22-19(25)15-7-2-3-8-16(15)20(22)26/h2-3,5-8,11,13H,4,9-10,12H2,1H3,(H,21,24)