N-[4-[1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylphenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[1-(4-nitrophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylphenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[1-(4-nitrophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylphenyl]naphthalene-2-carboxamide CAS Name: N-[4-[[1-(4-nitrophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[1-(4-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylphenyl]naphthalene-2-carboxamide Traditional Name: N-[4-[[2,5-diketo-1-(4-nitrophenyl)pyrrolidin-3-yl]thio]phenyl]-2-naphthamide Formula: C27H19N3O5S MolecularWeight: 497.52186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=C(C=C3)NC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H19N3O5S/c31-25-16-24(27(33)29(25)21-9-11-22(12-10-21)30(34)35)36-23-13-7-20(8-14-23)28-26(32)19-6-5-17-3-1-2-4-18(17)15-19/h1-15,24H,16H2,(H,28,32)