2-[4-[7-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyl]-9H-thioxanthen-2-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[7-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyl]-9H-thioxanthen-2-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[7-[4-(1,3-dioxoisoindolin-2-yl)butanoyl]-9H-thioxanthen-2-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[7-[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]-9H-thioxanthen-2-yl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[7-[4-(1,3-dioxoisoindol-2-yl)butanoyl]-9H-thioxanthen-2-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-keto-4-[7-(4-phthalimidobutanoyl)-9H-thioxanthen-2-yl]butyl]isoindoline-1,3-quinone Formula: C37H28N2O6S MolecularWeight: 628.69302

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)SC5=C1C=C(C=C5)C(=O)CCCN6C(=O)C7=CC=CC=C7C6=O

Isomeric SMILES

C1C2=C(C=CC(=C2)C(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)SC5=C1C=C(C=C5)C(=O)CCCN6C(=O)C7=CC=CC=C7C6=O

InChI

InChI=1S/C37H28N2O6S/c40-30(11-5-17-38-34(42)26-7-1-2-8-27(26)35(38)43)22-13-15-32-24(19-22)21-25-20-23(14-16-33(25)46-32)31(41)12-6-18-39-36(44)28-9-3-4-10-29(28)37(39)45/h1-4,7-10,13-16,19-20H,5-6,11-12,17-18,21H2