N-[(3-methylphenyl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: N-[(3-methylphenyl)carbamothioyl]-4-nitro-benzamide Openeye Name: N-(m-tolylcarbamothioyl)-4-nitro-benzamide CAS Name: N-[(3-methylanilino)-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[(3-methylphenyl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-(m-tolylthiocarbamoyl)-4-nitro-benzamide Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O3S/c1-10-3-2-4-12(9-10)16-15(22)17-14(19)11-5-7-13(8-6-11)18(20)21/h2-9H,1H3,(H2,16,17,19,22)