N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[3-(1,3-dithian-2-yl)phenyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C25H28N2O2S2 MolecularWeight: 452.63202

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2S2/c28-23(11-10-19-6-2-1-3-7-19)27-14-12-20(13-15-27)24(29)26-22-9-4-8-21(18-22)25-30-16-5-17-31-25/h1-4,6-11,18,20,25H,5,12-17H2,(H,26,29)/b11-10+