3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]propionamide Formula: C25H25ClN2O2S MolecularWeight: 452.9962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C25H25ClN2O2S/c26-23-11-5-4-10-20(23)12-17-24(29)28-25(31)27-21-13-15-22(16-14-21)30-18-6-9-19-7-2-1-3-8-19/h1-5,7-8,10-11,13-16H,6,9,12,17-18H2,(H2,27,28,29,31)