2-chloranyl-5-nitro-N-phenyl-N-[4-(phenylcarbamothioylamino)phenyl]benzamide

Systemtic Name: 2-chloranyl-5-nitro-N-phenyl-N-[4-(phenylcarbamothioylamino)phenyl]benzamide Openeye Name: 2-chloro-5-nitro-N-phenyl-N-[4-(phenylcarbamothioylamino)phenyl]benzamide CAS Name: N-[4-[[anilino(sulfanylidene)methyl]amino]phenyl]-2-chloro-5-nitro-N-phenylbenzamide IUPAC Name: 2-chloro-5-nitro-N-phenyl-N-[4-(phenylcarbamothioylamino)phenyl]benzamide Traditional Name: 2-chloro-5-nitro-N-phenyl-N-[4-(phenylthiocarbamoylamino)phenyl]benzamide Formula: C26H19ClN4O3S MolecularWeight: 502.97206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)N(C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)N(C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H19ClN4O3S/c27-24-16-15-22(31(33)34)17-23(24)25(32)30(20-9-5-2-6-10-20)21-13-11-19(12-14-21)29-26(35)28-18-7-3-1-4-8-18/h1-17H,(H2,28,29,35)