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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C28H25N3O2S MolecularWeight: 467.582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C28H25N3O2S/c32-26(14-13-20-7-2-1-3-8-20)31-17-15-21(16-18-31)27(33)29-23-10-6-9-22(19-23)28-30-24-11-4-5-12-25(24)34-28/h1-14,19,21H,15-18H2,(H,29,33)/b14-13+