4-ethoxy-3-nitro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-3-nitro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-ethoxy-3-nitro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-ethoxy-3-nitro-N-[[4-(1-oxopropylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethoxy-3-nitro-N-[[4-(propanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-ethoxy-3-nitro-N-[(4-propionamidophenyl)thiocarbamoyl]benzamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O5S/c1-3-17(24)20-13-6-8-14(9-7-13)21-19(29)22-18(25)12-5-10-16(28-4-2)15(11-12)23(26)27/h5-11H,3-4H2,1-2H3,(H,20,24)(H2,21,22,25,29)