1-(1,3-benzoxazol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-(3-pyrrolidinosulfonylphenyl)isonipecotamide Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C23H26N4O4S/c28-22(24-18-6-5-7-19(16-18)32(29,30)27-12-3-4-13-27)17-10-14-26(15-11-17)23-25-20-8-1-2-9-21(20)31-23/h1-2,5-9,16-17H,3-4,10-15H2,(H,24,28)