N-[1,3-bis(oxidanylidene)isoindol-5-yl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[1,3-bis(oxidanylidene)isoindol-5-yl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-(1,3-dioxoisoindolin-5-yl)-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-(1,3-dioxo-5-isoindolyl)-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-(1,3-dioxoisoindol-5-yl)-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(1,3-diketoisoindolin-5-yl)-2-[(4-nitrobenzyl)thio]acetamide Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5S/c21-15(9-26-8-10-1-4-12(5-2-10)20(24)25)18-11-3-6-13-14(7-11)17(23)19-16(13)22/h1-7H,8-9H2,(H,18,21)(H,19,22,23)