N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide Openeye Name: 1-(benzylcarbamoylamino)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]cyclopentanecarboxamide CAS Name: 1-[[oxo-[(phenylmethyl)amino]methyl]amino]-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzylcarbamoylamino)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]cyclopentane-1-carboxamide Traditional Name: 1-(benzylcarbamoylamino)-N-[6-(3-ketopiperazino)-3-pyridyl]cyclopentanecarboxamide Formula: C23H28N6O3 MolecularWeight: 436.50682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C23H28N6O3/c30-20-16-29(13-12-24-20)19-9-8-18(15-25-19)27-21(31)23(10-4-5-11-23)28-22(32)26-14-17-6-2-1-3-7-17/h1-3,6-9,15H,4-5,10-14,16H2,(H,24,30)(H,27,31)(H2,26,28,32)