4-butoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(4-methoxy-3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(4-methoxy-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(4-methoxy-3-nitro-phenyl)thiocarbamoyl]benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-3-4-11-27-15-8-5-13(6-9-15)18(23)21-19(28)20-14-7-10-17(26-2)16(12-14)22(24)25/h5-10,12H,3-4,11H2,1-2H3,(H2,20,21,23,28)