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

Systemtic Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: N-[[3-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H22N2O2S/c26-22(19-12-5-2-6-13-19)25-23(28)24-20-14-7-15-21(17-20)27-16-8-11-18-9-3-1-4-10-18/h1-7,9-10,12-15,17H,8,11,16H2,(H2,24,25,26,28)