N-(2-chloranyl-5-nitro-phenyl)-3-oxidanylidene-2,4-dihydroquinoxaline-1-carbothioamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-3-oxidanylidene-2,4-dihydroquinoxaline-1-carbothioamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide CAS Name: N-(2-chloro-5-nitrophenyl)-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-3-keto-2,4-dihydroquinoxaline-1-carbothioamide Formula: C15H11ClN4O3S MolecularWeight: 362.79084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1C(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN4O3S/c16-10-6-5-9(20(22)23)7-12(10)18-15(24)19-8-14(21)17-11-3-1-2-4-13(11)19/h1-7H,8H2,(H,17,21)(H,18,24)