N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]-3-nitro-benzamide Openeye Name: N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[3-(2-methoxyethoxy)anilino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[3-(2-methoxyethoxy)phenyl]thiocarbamoyl]-3-nitro-benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c1-24-8-9-25-15-7-3-5-13(11-15)18-17(26)19-16(21)12-4-2-6-14(10-12)20(22)23/h2-7,10-11H,8-9H2,1H3,(H2,18,19,21,26)