4-(1-phenylsulfanyldecyl)isoindole-1,3-dione

Systemtic Name: 4-(1-phenylsulfanyldecyl)isoindole-1,3-dione Openeye Name: 4-(1-phenylsulfanyldecyl)isoindoline-1,3-dione CAS Name: 4-[1-(phenylthio)decyl]isoindole-1,3-dione IUPAC Name: 4-(1-phenylsulfanyldecyl)isoindole-1,3-dione Traditional Name: 4-[1-(phenylthio)decyl]isoindoline-1,3-quinone Formula: C24H29NO2S MolecularWeight: 395.55756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1=CC=CC2=C1C(=O)NC2=O)SC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCC(C1=CC=CC2=C1C(=O)NC2=O)SC3=CC=CC=C3

InChI

InChI=1S/C24H29NO2S/c1-2-3-4-5-6-7-11-17-21(28-18-13-9-8-10-14-18)19-15-12-16-20-22(19)24(27)25-23(20)26/h8-10,12-16,21H,2-7,11,17H2,1H3,(H,25,26,27)