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

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-benzo[e][1,3]benzothiazol-2-yl-piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-(2-benzo[e][1,3]benzothiazolyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-benzo[e][1,3]benzothiazol-2-ylpiperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-benzo[e][1,3]benzothiazol-2-yl-isonipecotamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C25H23N3O4S2/c1-16(29)17-6-9-20(10-7-17)34(31,32)28-14-12-19(13-15-28)24(30)27-25-26-23-21-5-3-2-4-18(21)8-11-22(23)33-25/h2-11,19H,12-15H2,1H3,(H,26,27,30)