2-[2,4-bis(oxidanylidene)-4-phenyl-1-sulfanyl-butyl]isoindole-1,3-dione

Systemtic Name: 2-[2,4-bis(oxidanylidene)-4-phenyl-1-sulfanyl-butyl]isoindole-1,3-dione Openeye Name: 2-(2,4-dioxo-4-phenyl-1-sulfanyl-butyl)isoindoline-1,3-dione CAS Name: 2-(1-mercapto-2,4-dioxo-4-phenylbutyl)isoindole-1,3-dione IUPAC Name: 2-(2,4-dioxo-4-phenyl-1-sulfanylbutyl)isoindole-1,3-dione Traditional Name: 2-(2,4-diketo-1-mercapto-4-phenyl-butyl)isoindoline-1,3-quinone Formula: C18H13NO4S MolecularWeight: 339.36512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(=O)C(N2C(=O)C3=CC=CC=C3C2=O)S

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(=O)C(N2C(=O)C3=CC=CC=C3C2=O)S

InChI

InChI=1S/C18H13NO4S/c20-14(11-6-2-1-3-7-11)10-15(21)18(24)19-16(22)12-8-4-5-9-13(12)17(19)23/h1-9,18,24H,10H2