N1'-phenethyl-N1'-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]carbamoyl]cyclopentane-1,1-dicarboxamide

Systemtic Name: N1'-phenethyl-N1'-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]carbamoyl]cyclopentane-1,1-dicarboxamide Openeye Name: N1'-phenethyl-N1'-[[1-(2-pyridylmethyl)-4-piperidyl]carbamoyl]cyclopentane-1,1-dicarboxamide CAS Name: N1'-[oxo-[[1-(2-pyridinylmethyl)-4-piperidinyl]amino]methyl]-N1'-phenethylcyclopentane-1,1-dicarboxamide IUPAC Name: 1-N'-phenethyl-1-N'-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]carbamoyl]cyclopentane-1,1-dicarboxamide Traditional Name: N'-phenethyl-N'-[[1-(2-pyridylmethyl)-4-piperidyl]carbamoyl]cyclopentane-1,1-dicarboxamide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)N)C(=O)N(CCC2=CC=CC=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

C1CCC(C1)(C(=O)N)C(=O)N(CCC2=CC=CC=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C27H35N5O3/c28-24(33)27(14-5-6-15-27)25(34)32(19-11-21-8-2-1-3-9-21)26(35)30-22-12-17-31(18-13-22)20-23-10-4-7-16-29-23/h1-4,7-10,16,22H,5-6,11-15,17-20H2,(H2,28,33)(H,30,35)