3-nitro-N-(1-phenylpropylcarbamothioyl)benzamide

Systemtic Name: 3-nitro-N-(1-phenylpropylcarbamothioyl)benzamide Openeye Name: 3-nitro-N-(1-phenylpropylcarbamothioyl)benzamide CAS Name: 3-nitro-N-[(1-phenylpropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-nitro-N-(1-phenylpropylcarbamothioyl)benzamide Traditional Name: 3-nitro-N-(1-phenylpropylthiocarbamoyl)benzamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O3S/c1-2-15(12-7-4-3-5-8-12)18-17(24)19-16(21)13-9-6-10-14(11-13)20(22)23/h3-11,15H,2H2,1H3,(H2,18,19,21,24)