S-(4-chlorophenyl) N-(4-chloranyl-3-nitro-phenyl)carbamothioate

Systemtic Name: S-(4-chlorophenyl) N-(4-chloranyl-3-nitro-phenyl)carbamothioate Openeye Name: S-(4-chlorophenyl) N-(4-chloro-3-nitro-phenyl)carbamothioate CAS Name: N-(4-chloro-3-nitrophenyl)carbamothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) N-(4-chloro-3-nitrophenyl)carbamothioate Traditional Name: N-(4-chloro-3-nitro-phenyl)thiocarbamic acid S-(4-chlorophenyl) ester Formula: C13H8Cl2N2O3S MolecularWeight: 343.18522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1SC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8Cl2N2O3S/c14-8-1-4-10(5-2-8)21-13(18)16-9-3-6-11(15)12(7-9)17(19)20/h1-7H,(H,16,18)