4-butoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[(3-phenethyloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3-phenethyloxyphenyl)thiocarbamoyl]benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O3S/c1-2-3-17-30-23-14-12-21(13-15-23)25(29)28-26(32)27-22-10-7-11-24(19-22)31-18-16-20-8-5-4-6-9-20/h4-15,19H,2-3,16-18H2,1H3,(H2,27,28,29,32)