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

Systemtic Name: 4-pentoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide Openeye Name: 4-pentoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide CAS Name: 4-pentoxy-N-[(3-phenethyloxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-pentoxy-N-[(3-phenethyloxyphenyl)carbamothioyl]benzamide Traditional Name: 4-amoxy-N-[(3-phenethyloxyphenyl)thiocarbamoyl]benzamide Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O3S/c1-2-3-7-18-31-24-15-13-22(14-16-24)26(30)29-27(33)28-23-11-8-12-25(20-23)32-19-17-21-9-5-4-6-10-21/h4-6,8-16,20H,2-3,7,17-19H2,1H3,(H2,28,29,30,33)