4-chloranyl-3-nitro-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-4-chloro-3-nitro-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-4-chloro-3-nitrobenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-4-chloro-3-nitro-benzamide Formula: C20H15ClN4O3S MolecularWeight: 426.8761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN4O3S/c21-17-11-6-13(12-18(17)25(27)28)19(26)24-20(29)23-16-9-7-15(8-10-16)22-14-4-2-1-3-5-14/h1-12,22H,(H2,23,24,26,29)