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

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

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(CC(C)C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(CC(C)C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H26N2O5S/c1-4-34-27(33)22-20(17-10-6-5-7-11-17)15-35-24(22)28-23(30)21(14-16(2)3)29-25(31)18-12-8-9-13-19(18)26(29)32/h5-13,15-16,21H,4,14H2,1-3H3,(H,28,30)