N-[(3-piperidin-1-ylcarbonylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(3-piperidin-1-ylcarbonylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[[3-(piperidine-1-carbonyl)phenyl]methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[[3-[oxo(1-piperidinyl)methyl]phenyl]methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[[3-(piperidine-1-carbonyl)phenyl]methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(piperidine-1-carbonyl)benzyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CNC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CNC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H29N3O4S2/c27-22(20-9-5-13-26(17-20)32(29,30)21-10-6-14-31-21)24-16-18-7-4-8-19(15-18)23(28)25-11-2-1-3-12-25/h4,6-8,10,14-15,20H,1-3,5,9,11-13,16-17H2,(H,24,27)