4-methoxy-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 4-methoxy-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 4-methoxy-3-nitro-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 4-methoxy-3-nitro-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-methoxy-3-nitro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 4-methoxy-3-nitro-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N4O4S/c1-23-13-5-4-11(7-12(13)19(21)22)14(20)18-15(24)17-9-10-3-2-6-16-8-10/h2-8H,9H2,1H3,(H2,17,18,20,24)