N-(1,3-benzothiazol-2-yl)-1-(3-ethanoylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(3-ethanoylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-(1,3-benzothiazol-2-yl)-N-methyl-piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-(1,3-benzothiazol-2-yl)-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-(1,3-benzothiazol-2-yl)-N-methylpiperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-(1,3-benzothiazol-2-yl)-N-methyl-isonipecotamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O4S2/c1-15(26)17-6-5-7-18(14-17)31(28,29)25-12-10-16(11-13-25)21(27)24(2)22-23-19-8-3-4-9-20(19)30-22/h3-9,14,16H,10-13H2,1-2H3