N-benzo[e][1,3]benzothiazol-2-yl-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)S(=O)(=O)C=CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)S(=O)(=O)/C=C/C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O3S2/c29-24(27-25-26-23-21-9-5-4-8-19(21)10-11-22(23)32-25)20-12-15-28(16-13-20)33(30,31)17-14-18-6-2-1-3-7-18/h1-11,14,17,20H,12-13,15-16H2,(H,26,27,29)/b17-14+