N-[(2-aminocarbonylphenyl)carbamothioyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[(2-aminocarbonylphenyl)carbamothioyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[(2-carbamoylphenyl)carbamothioyl]-3-methyl-4-nitro-benzamide CAS Name: N-[(2-carbamoylanilino)-sulfanylidenemethyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[(2-carbamoylphenyl)carbamothioyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[(2-carbamoylphenyl)thiocarbamoyl]-3-methyl-4-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O4S/c1-9-8-10(6-7-13(9)20(23)24)15(22)19-16(25)18-12-5-3-2-4-11(12)14(17)21/h2-8H,1H3,(H2,17,21)(H2,18,19,22,25)