N-[ethyl(phenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[ethyl(phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[ethyl(phenyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[(N-ethylanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[ethyl(phenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[ethyl(phenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c1-2-18(13-8-4-3-5-9-13)16(23)17-15(20)12-7-6-10-14(11-12)19(21)22/h3-11H,2H2,1H3,(H,17,20,23)