N-(dimethylaminomethylidene)-2,3-dinitro-6-phenylazanyl-benzenecarbothioamide

Systemtic Name: N-(dimethylaminomethylidene)-2,3-dinitro-6-phenylazanyl-benzenecarbothioamide Openeye Name: 6-anilino-N-(dimethylaminomethylene)-2,3-dinitro-benzenecarbothioamide CAS Name: 6-anilino-N-(dimethylaminomethylidene)-2,3-dinitrobenzenecarbothioamide IUPAC Name: 6-anilino-N-(dimethylaminomethylidene)-2,3-dinitrobenzenecarbothioamide Traditional Name: 6-anilino-N-(dimethylaminomethylene)-2,3-dinitro-thiobenzamide Formula: C16H15N5O4S MolecularWeight: 373.3864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N5O4S/c1-19(2)10-17-16(26)14-12(18-11-6-4-3-5-7-11)8-9-13(20(22)23)15(14)21(24)25/h3-10,18H,1-2H3