N-[[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[4-(3-oxo-3-pyrrolidin-1-yl-propyl)phenyl]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[4-[3-oxo-3-(1-pyrrolidinyl)propyl]anilino]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[4-(3-keto-3-pyrrolidino-propyl)phenyl]thiocarbamoyl]-3-phenyl-propionamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O2S/c27-21(14-10-18-6-2-1-3-7-18)25-23(29)24-20-12-8-19(9-13-20)11-15-22(28)26-16-4-5-17-26/h1-3,6-9,12-13H,4-5,10-11,14-17H2,(H2,24,25,27,29)