2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazol-4-yl]phenyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazol-4-yl]phenyl]isoindole-1,3-dione Openeye Name: 2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-thiazol-4-yl]phenyl]isoindoline-1,3-dione CAS Name: 2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-4-thiazolyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-1,3-thiazol-4-yl]phenyl]isoindole-1,3-dione Traditional Name: 2-[3-[3-propyl-2-[3-(trifluoromethyl)phenyl]imino-4-thiazolin-4-yl]phenyl]isoindoline-1,3-quinone Formula: C27H20F3N3O2S MolecularWeight: 507.52681

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CSC1=NC2=CC=CC(=C2)C(F)(F)F)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCCN1C(=CSC1=NC2=CC=CC(=C2)C(F)(F)F)C3=CC(=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H20F3N3O2S/c1-2-13-32-23(16-36-26(32)31-19-9-6-8-18(15-19)27(28,29)30)17-7-5-10-20(14-17)33-24(34)21-11-3-4-12-22(21)25(33)35/h3-12,14-16H,2,13H2,1H3