(E)-3-phenyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-phenyl-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-phenyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[(4-pyrrolidinophenyl)thiocarbamoyl]acrylamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3OS/c24-19(13-8-16-6-2-1-3-7-16)22-20(25)21-17-9-11-18(12-10-17)23-14-4-5-15-23/h1-3,6-13H,4-5,14-15H2,(H2,21,22,24,25)/b13-8+