N-(1,4-dioxan-2-ylmethyl)-2-oxidanylidene-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1H-pyridine-3-carboxamide

Systemtic Name: N-(1,4-dioxan-2-ylmethyl)-2-oxidanylidene-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1H-pyridine-3-carboxamide Openeye Name: N-(1,4-dioxan-2-ylmethyl)-2-oxo-6-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1H-pyridine-3-carboxamide CAS Name: N-(1,4-dioxan-2-ylmethyl)-2-oxo-6-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1H-pyridine-3-carboxamide IUPAC Name: N-(1,4-dioxan-2-ylmethyl)-2-oxo-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1H-pyridine-3-carboxamide Traditional Name: N-(1,4-dioxan-2-ylmethyl)-2-keto-6-[[4-(2-pyridyl)piperazino]methyl]-1H-pyridine-3-carboxamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C(=O)N2)C(=O)NCC3COCCO3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C(=O)N2)C(=O)NCC3COCCO3)C4=CC=CC=N4

InChI

InChI=1S/C21H27N5O4/c27-20(23-13-17-15-29-11-12-30-17)18-5-4-16(24-21(18)28)14-25-7-9-26(10-8-25)19-3-1-2-6-22-19/h1-6,17H,7-15H2,(H,23,27)(H,24,28)