4-ethoxy-N-[naphthalen-2-yl(phenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-ethoxy-N-[naphthalen-2-yl(phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-ethoxy-N-[2-naphthyl(phenyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-ethoxy-N-[[N-(2-naphthalenyl)anilino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-[naphthalen-2-yl(phenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-ethoxy-N-[2-naphthyl(phenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C26H21N3O4S MolecularWeight: 471.52764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N(C2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N(C2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H21N3O4S/c1-2-33-24-15-13-20(17-23(24)29(31)32)25(30)27-26(34)28(21-10-4-3-5-11-21)22-14-12-18-8-6-7-9-19(18)16-22/h3-17H,2H2,1H3,(H,27,30,34)