2-nitro-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-nitro-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O3S/c25-19(17-8-4-5-9-18(17)24(26)27)23-20(28)22-16-12-10-15(11-13-16)21-14-6-2-1-3-7-14/h1-13,21H,(H2,22,23,25,28)