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

Systemtic Name: N-[(2-methyl-4-nitro-phenyl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[(2-methyl-4-nitro-phenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(2-methyl-4-nitrophenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(2-methyl-4-nitro-phenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C15H12N4O5S MolecularWeight: 360.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O5S/c1-9-8-10(18(21)22)6-7-12(9)16-15(25)17-14(20)11-4-2-3-5-13(11)19(23)24/h2-8H,1H3,(H2,16,17,20,25)