3-nitro-N-(phenethylcarbamothioyl)benzamide

Systemtic Name: 3-nitro-N-(phenethylcarbamothioyl)benzamide Openeye Name: 3-nitro-N-(phenethylcarbamothioyl)benzamide CAS Name: 3-nitro-N-[(phenethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-(phenethylcarbamothioyl)benzamide Traditional Name: 3-nitro-N-(phenethylthiocarbamoyl)benzamide Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c20-15(13-7-4-8-14(11-13)19(21)22)18-16(23)17-10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H2,17,18,20,23)