(E)-3-phenyl-N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[(3-piperidin-1-ylcarbonylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-N-[[3-[oxo(1-piperidinyl)methyl]anilino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-3-phenyl-N-[[3-(piperidine-1-carbonyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[[3-(piperidine-1-carbonyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2S/c26-20(13-12-17-8-3-1-4-9-17)24-22(28)23-19-11-7-10-18(16-19)21(27)25-14-5-2-6-15-25/h1,3-4,7-13,16H,2,5-6,14-15H2,(H2,23,24,26,28)/b13-12+