N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[3-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[3-(3-phenylpropoxy)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O3S/c1-2-17-30-23-15-13-21(14-16-23)25(29)28-26(32)27-22-11-6-12-24(19-22)31-18-7-10-20-8-4-3-5-9-20/h3-6,8-9,11-16,19H,2,7,10,17-18H2,1H3,(H2,27,28,29,32)