N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-1-propylsulfonyl-nipecotamide Formula: C21H33N3O6S2 MolecularWeight: 487.63322

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H33N3O6S2/c1-3-14-31(26,27)24-13-7-8-17(16-24)21(25)22-18-9-10-19(30-2)20(15-18)32(28,29)23-11-5-4-6-12-23/h9-10,15,17H,3-8,11-14,16H2,1-2H3,(H,22,25)