N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]cyclopentanecarboxamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]cyclopentanecarboxamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]cyclopentanecarboxamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]cyclopentanecarboxamide Formula: C13H14ClN3O3S MolecularWeight: 327.78656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H14ClN3O3S/c14-10-6-5-9(7-11(10)17(19)20)15-13(21)16-12(18)8-3-1-2-4-8/h5-8H,1-4H2,(H2,15,16,18,21)