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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2S/c1-2-27(24-25-20-10-6-7-11-21(20)30-24)23(29)19-14-16-26(17-15-19)22(28)13-12-18-8-4-3-5-9-18/h3-13,19H,2,14-17H2,1H3/b13-12+