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

Systemtic Name: 4-heptoxy-N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[3-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[3-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C30H36N2O3S MolecularWeight: 504.68344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C30H36N2O3S/c1-2-3-4-5-9-21-34-27-19-17-25(18-20-27)29(33)32-30(36)31-26-15-10-16-28(23-26)35-22-11-14-24-12-7-6-8-13-24/h6-8,10,12-13,15-20,23H,2-5,9,11,14,21-22H2,1H3,(H2,31,32,33,36)