3-chloranyl-N-[4-[3-(4-chloranyl-3-nitro-phenyl)prop-2-enoylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 3-chloranyl-N-[4-[3-(4-chloranyl-3-nitro-phenyl)prop-2-enoylcarbamothioylamino]phenyl]benzamide Openeye Name: 3-chloro-N-[4-[3-(4-chloro-3-nitro-phenyl)prop-2-enoylcarbamothioylamino]phenyl]benzamide CAS Name: 3-chloro-N-[4-[[[[3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[3-(4-chloro-3-nitrophenyl)prop-2-enoylcarbamothioylamino]phenyl]benzamide Traditional Name: 3-chloro-N-[4-[[3-(4-chloro-3-nitro-phenyl)acryloyl]thiocarbamoylamino]phenyl]benzamide Formula: C23H16Cl2N4O4S MolecularWeight: 515.36854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H16Cl2N4O4S/c24-16-3-1-2-15(13-16)22(31)26-17-6-8-18(9-7-17)27-23(34)28-21(30)11-5-14-4-10-19(25)20(12-14)29(32)33/h1-13H,(H,26,31)(H2,27,28,30,34)