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

Systemtic Name: 4-ethoxy-3-nitro-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Openeye Name: 4-ethoxy-3-nitro-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide CAS Name: 4-ethoxy-3-nitro-N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-ethoxy-3-nitro-N-[4-(propanoylcarbamothioylamino)phenyl]benzamide Traditional Name: 4-ethoxy-3-nitro-N-[4-(propionylthiocarbamoylamino)phenyl]benzamide Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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