4-butoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4S/c1-2-3-12-25-16-10-4-13(5-11-16)17(22)20-18(26)19-14-6-8-15(9-7-14)21(23)24/h4-11H,2-3,12H2,1H3,(H2,19,20,22,26)