6-[[4-(1-adamantyl)piperazin-1-yl]methyl]-2-oxidanylidene-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide

Systemtic Name: 6-[[4-(1-adamantyl)piperazin-1-yl]methyl]-2-oxidanylidene-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide Openeye Name: 6-[[4-(1-adamantyl)piperazin-1-yl]methyl]-2-oxo-N-(2-thienylmethyl)-1H-pyridine-3-carboxamide CAS Name: 6-[[4-(1-adamantyl)-1-piperazinyl]methyl]-2-oxo-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide IUPAC Name: 6-[[4-(1-adamantyl)piperazin-1-yl]methyl]-2-oxo-N-(thiophen-2-ylmethyl)-1H-pyridine-3-carboxamide Traditional Name: 6-[[4-(1-adamantyl)piperazino]methyl]-2-keto-N-(2-thenyl)-1H-pyridine-3-carboxamide Formula: C26H34N4O2S MolecularWeight: 466.63876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC=CS3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C(=O)N2)C(=O)NCC3=CC=CS3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H34N4O2S/c31-24(27-16-22-2-1-9-33-22)23-4-3-21(28-25(23)32)17-29-5-7-30(8-6-29)26-13-18-10-19(14-26)12-20(11-18)15-26/h1-4,9,18-20H,5-8,10-17H2,(H,27,31)(H,28,32)