ethyl 2-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-dioxoisoindolin-2-yl)-3-methyl-pentanoyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-3-methyl-1-oxopentyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-dioxoisoindol-2-yl)-3-methylpentanoyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(3-methyl-2-phthalimido-pentanoyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCC(C)C(C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H26N2O5S/c1-4-16(3)22(29-25(31)18-13-9-10-14-19(18)26(29)32)23(30)28-24-21(27(33)34-5-2)20(15-35-24)17-11-7-6-8-12-17/h6-16,22H,4-5H2,1-3H3,(H,28,30)