4-hexoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-hexoxy-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-4-hexoxy-benzamide Formula: C26H29N3O2S MolecularWeight: 447.59236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3

InChI

InChI=1S/C26H29N3O2S/c1-2-3-4-8-19-31-24-17-11-20(12-18-24)25(30)29-26(32)28-23-15-13-22(14-16-23)27-21-9-6-5-7-10-21/h5-7,9-18,27H,2-4,8,19H2,1H3,(H2,28,29,30,32)