2-(3-methylpiperazin-1-yl)-N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-(3-methylpiperazin-1-yl)-N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-(3-methyl-1-piperazinyl)-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-(3-methylpiperazino)nicotinamide Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)N(CC3CCCC3O)CC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1)C2=C(C=CC=N2)C(=O)N(C[C@@H]3CCC[C@@H]3O)CC4=CC=CC=C4

InChI

InChI=1S/C24H32N4O2/c1-18-15-27(14-13-25-18)23-21(10-6-12-26-23)24(30)28(16-19-7-3-2-4-8-19)17-20-9-5-11-22(20)29/h2-4,6-8,10,12,18,20,22,25,29H,5,9,11,13-17H2,1H3/t18?,20-,22-/m0/s1