N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-4-nitro-benzamide Openeye Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-4-nitro-benzamide CAS Name: N-[[[2-(4-chlorophenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-4-nitrobenzamide Traditional Name: N-[[[2-(4-chlorophenyl)acetyl]amino]thiocarbamoyl]-4-nitro-benzamide Formula: C16H13ClN4O4S MolecularWeight: 392.81682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H13ClN4O4S/c17-12-5-1-10(2-6-12)9-14(22)19-20-16(26)18-15(23)11-3-7-13(8-4-11)21(24)25/h1-8H,9H2,(H,19,22)(H2,18,20,23,26)