2-[cyclohexyl-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methoxy]isoindole-1,3-dione

Systemtic Name: 2-[cyclohexyl-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methoxy]isoindole-1,3-dione Openeye Name: 2-[cyclohexyl-[4-(thiazol-4-ylmethoxy)phenyl]methoxy]isoindoline-1,3-dione CAS Name: 2-[cyclohexyl-[4-(4-thiazolylmethoxy)phenyl]methoxy]isoindole-1,3-dione IUPAC Name: 2-[cyclohexyl-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methoxy]isoindole-1,3-dione Traditional Name: 2-[cyclohexyl-[4-(thiazol-4-ylmethoxy)phenyl]methoxy]isoindoline-1,3-quinone Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=C(C=C2)OCC3=CSC=N3)ON4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CCC(CC1)C(C2=CC=C(C=C2)OCC3=CSC=N3)ON4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H24N2O4S/c28-24-21-8-4-5-9-22(21)25(29)27(24)31-23(17-6-2-1-3-7-17)18-10-12-20(13-11-18)30-14-19-15-32-16-26-19/h4-5,8-13,15-17,23H,1-3,6-7,14H2