5-[[4-(4-ethanoylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-(4-ethanoylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-(4-acetyl-1-piperazinyl)-6-ethyl-2-pyrimidinyl]thio]methyl]-N-(2-pyridinylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanylmethyl]-N-(pyridin-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-(4-acetylpiperazino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-N-(2-pyridylmethyl)-2-furamide Formula: C24H28N6O3S MolecularWeight: 480.58252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3)N4CCN(CC4)C(=O)C

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=N3)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C24H28N6O3S/c1-3-18-14-22(30-12-10-29(11-13-30)17(2)31)28-24(27-18)34-16-20-7-8-21(33-20)23(32)26-15-19-6-4-5-9-25-19/h4-9,14H,3,10-13,15-16H2,1-2H3,(H,26,32)