4-(diphenylmethyl)-N-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]piperazine-1-carboxamide

Systemtic Name: 4-(diphenylmethyl)-N-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]piperazine-1-carboxamide Openeye Name: 4-benzhydryl-N-[6-(3-pyridylmethylcarbamoylamino)hexyl]piperazine-1-carboxamide CAS Name: 4-(diphenylmethyl)-N-[6-[[oxo-(3-pyridinylmethylamino)methyl]amino]hexyl]-1-piperazinecarboxamide IUPAC Name: 4-benzhydryl-N-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]piperazine-1-carboxamide Traditional Name: 4-benzhydryl-N-[6-(3-pyridylmethylcarbamoylamino)hexyl]piperazine-1-carboxamide Formula: C31H40N6O2 MolecularWeight: 528.6883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCCCCNC(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCCCCNC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C31H40N6O2/c38-30(35-25-26-12-11-17-32-24-26)33-18-9-1-2-10-19-34-31(39)37-22-20-36(21-23-37)29(27-13-5-3-6-14-27)28-15-7-4-8-16-28/h3-8,11-17,24,29H,1-2,9-10,18-23,25H2,(H,34,39)(H2,33,35,38)