N-[(4-butoxyphenyl)carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[(4-butoxyphenyl)carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[(4-butoxyphenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[(4-butoxyanilino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[(4-butoxyphenyl)carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[(4-butoxyphenyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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