4-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide

Systemtic Name: 4-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-2-carboxamide Openeye Name: 4-[(4-benzyl-1-piperidyl)methyl]-1-(2-thienylsulfonyl)piperidine-2-carboxamide CAS Name: 4-[[4-(phenylmethyl)-1-piperidinyl]methyl]-1-thiophen-2-ylsulfonyl-2-piperidinecarboxamide IUPAC Name: 4-[(4-benzylpiperidin-1-yl)methyl]-1-thiophen-2-ylsulfonylpiperidine-2-carboxamide Traditional Name: 4-[(4-benzylpiperidino)methyl]-1-(2-thienylsulfonyl)pipecolinamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3CCN(C(C3)C(=O)N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3CCN(C(C3)C(=O)N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H31N3O3S2/c24-23(27)21-16-20(10-13-26(21)31(28,29)22-7-4-14-30-22)17-25-11-8-19(9-12-25)15-18-5-2-1-3-6-18/h1-7,14,19-21H,8-13,15-17H2,(H2,24,27)