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

Systemtic Name: N-[2-methyl-1,3-bis(oxidanylidene)isoindol-5-yl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-(2-methyl-1,3-dioxo-isoindolin-5-yl)-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-(2-methyl-1,3-dioxo-5-isoindolyl)-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-(2-methyl-1,3-dioxoisoindol-5-yl)-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(1,3-diketo-2-methyl-isoindolin-5-yl)-2-[(4-nitrobenzyl)thio]acetamide Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O5S/c1-20-17(23)14-7-4-12(8-15(14)18(20)24)19-16(22)10-27-9-11-2-5-13(6-3-11)21(25)26/h2-8H,9-10H2,1H3,(H,19,22)