N-[4-(ethanoylcarbamothioylamino)phenyl]-3-nitro-benzamide

Systemtic Name: N-[4-(ethanoylcarbamothioylamino)phenyl]-3-nitro-benzamide Openeye Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-nitro-benzamide CAS Name: N-[4-[[acetamido(sulfanylidene)methyl]amino]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-nitrobenzamide Traditional Name: N-[4-(acetylthiocarbamoylamino)phenyl]-3-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c1-10(21)17-16(25)19-13-7-5-12(6-8-13)18-15(22)11-3-2-4-14(9-11)20(23)24/h2-9H,1H3,(H,18,22)(H2,17,19,21,25)