(E)-3-phenyl-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[[4-(4-pyridylmethyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-phenyl-N-[[4-(pyridin-4-ylmethyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-phenyl-N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[[4-(4-pyridylmethyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C22H19N3OS/c26-21(11-8-17-4-2-1-3-5-17)25-22(27)24-20-9-6-18(7-10-20)16-19-12-14-23-15-13-19/h1-15H,16H2,(H2,24,25,26,27)/b11-8+