3-cyclohexyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[[3-[(1-oxo-3-phenylpropyl)amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[[3-(hydrocinnamoylamino)phenyl]thiocarbamoyl]propionamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O2S/c29-23(16-14-19-8-3-1-4-9-19)26-21-12-7-13-22(18-21)27-25(31)28-24(30)17-15-20-10-5-2-6-11-20/h1,3-4,7-9,12-13,18,20H,2,5-6,10-11,14-17H2,(H,26,29)(H2,27,28,30,31)