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

Systemtic Name: N-[(2-chloranylpyridin-3-yl)carbamothioyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[(2-chloro-3-pyridyl)carbamothioyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[[(2-chloro-3-pyridinyl)amino]-sulfanylidenemethyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[(2-chloropyridin-3-yl)carbamothioyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[(2-chloro-3-pyridyl)thiocarbamoyl]-4-ethoxy-3-nitro-benzamide Formula: C15H13ClN4O4S MolecularWeight: 380.80612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(N=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(N=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H13ClN4O4S/c1-2-24-12-6-5-9(8-11(12)20(22)23)14(21)19-15(25)18-10-4-3-7-17-13(10)16/h3-8H,2H2,1H3,(H2,18,19,21,25)