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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-nitrophenyl)carbamothioyl]ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-[(2-nitrophenyl)carbamothioyl]acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[(2-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-[(2-nitrophenyl)carbamothioyl]acetamide Traditional Name: N-[(2-nitrophenyl)thiocarbamoyl]-2-phthalimido-acetamide Formula: C17H12N4O5S MolecularWeight: 384.36598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NC(=S)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)NC(=S)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O5S/c22-14(9-20-15(23)10-5-1-2-6-11(10)16(20)24)19-17(27)18-12-7-3-4-8-13(12)21(25)26/h1-8H,9H2,(H2,18,19,22,27)