N-[4-(4-nitrophenyl)sulfanylphenyl]-1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindole-5-carboxamide

Systemtic Name: N-[4-(4-nitrophenyl)sulfanylphenyl]-1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindole-5-carboxamide Openeye Name: N-[4-(4-nitrophenyl)sulfanylphenyl]-1,3-dioxo-2-(2-phenylphenyl)isoindoline-5-carboxamide CAS Name: N-[4-[(4-nitrophenyl)thio]phenyl]-1,3-dioxo-2-(2-phenylphenyl)-5-isoindolecarboxamide IUPAC Name: N-[4-(4-nitrophenyl)sulfanylphenyl]-1,3-dioxo-2-(2-phenylphenyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-[4-[(4-nitrophenyl)thio]phenyl]-2-(2-phenylphenyl)isoindoline-5-carboxamide Formula: C33H21N3O5S MolecularWeight: 571.60194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=CC=C(C=C5)SC6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=CC=C(C=C5)SC6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C33H21N3O5S/c37-31(34-23-11-15-25(16-12-23)42-26-17-13-24(14-18-26)36(40)41)22-10-19-28-29(20-22)33(39)35(32(28)38)30-9-5-4-8-27(30)21-6-2-1-3-7-21/h1-20H,(H,34,37)