3-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide CAS Name: 3-ethoxy-N-[(3-hexoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-ethoxy-N-[(3-hexoxyphenyl)thiocarbamoyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

InChI

InChI=1S/C22H28N2O3S/c1-3-5-6-7-14-27-20-13-9-11-18(16-20)23-22(28)24-21(25)17-10-8-12-19(15-17)26-4-2/h8-13,15-16H,3-7,14H2,1-2H3,(H2,23,24,25,28)