(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-[4-(5-methyl-2-propan-2-yl-phenoxy)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-[4-(5-methyl-2-propan-2-yl-phenoxy)phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-[4-(2-isopropyl-5-methyl-phenoxy)phenyl]-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-(5-methyl-2-propan-2-ylphenoxy)phenyl]-1,3-dioxo-5-isoindolecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-[4-(5-methyl-2-propan-2-ylphenoxy)phenyl]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-[4-(2-isopropyl-5-methyl-phenoxy)phenyl]-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C31H25NO6S MolecularWeight: 539.5983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC(=O)C5=CC=CS5

InChI

InChI=1S/C31H25NO6S/c1-18(2)23-12-6-19(3)15-27(23)38-22-10-8-21(9-11-22)32-29(34)24-13-7-20(16-25(24)30(32)35)31(36)37-17-26(33)28-5-4-14-39-28/h4-16,18H,17H2,1-3H3