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

Systemtic Name: 4-chloranyl-3-nitro-N-[(4-phenoxyphenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-3-nitro-N-[(4-phenoxyphenyl)carbamothioyl]benzamide CAS Name: 4-chloro-3-nitro-N-[(4-phenoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[(4-phenoxyphenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-3-nitro-N-[(4-phenoxyphenyl)thiocarbamoyl]benzamide Formula: C20H14ClN3O4S MolecularWeight: 427.86086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClN3O4S/c21-17-11-6-13(12-18(17)24(26)27)19(25)23-20(29)22-14-7-9-16(10-8-14)28-15-4-2-1-3-5-15/h1-12H,(H2,22,23,25,29)