N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethyl-1-pyrazolyl)ethyl]-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-(2-thienylsulfonyl)pipecolinamide Formula: C24H27N5O3S3 MolecularWeight: 529.69788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCN(C2=NC3=CC=CC=C3S2)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5)C

Isomeric SMILES

CC1=CC(=NN1CCN(C2=NC3=CC=CC=C3S2)C(=O)C4CCCCN4S(=O)(=O)C5=CC=CS5)C

InChI

InChI=1S/C24H27N5O3S3/c1-17-16-18(2)28(26-17)14-13-27(24-25-19-8-3-4-10-21(19)34-24)23(30)20-9-5-6-12-29(20)35(31,32)22-11-7-15-33-22/h3-4,7-8,10-11,15-16,20H,5-6,9,12-14H2,1-2H3