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

Systemtic Name: 5-[[4-(4-ethanoylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(oxolan-2-ylmethyl)furan-2-carboxamide Openeye Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(tetrahydrofuran-2-ylmethyl)furan-2-carboxamide CAS Name: 5-[[[4-(4-acetyl-1-piperazinyl)-6-ethyl-2-pyrimidinyl]thio]methyl]-N-(2-oxolanylmethyl)-2-furancarboxamide IUPAC Name: 5-[[4-(4-acetylpiperazin-1-yl)-6-ethylpyrimidin-2-yl]sulfanylmethyl]-N-(oxolan-2-ylmethyl)furan-2-carboxamide Traditional Name: 5-[[[4-(4-acetylpiperazino)-6-ethyl-pyrimidin-2-yl]thio]methyl]-N-(tetrahydrofurfuryl)-2-furamide Formula: C23H31N5O4S MolecularWeight: 473.58834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CCCO3)N4CCN(CC4)C(=O)C

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3CCCO3)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C23H31N5O4S/c1-3-17-13-21(28-10-8-27(9-11-28)16(2)29)26-23(25-17)33-15-19-6-7-20(32-19)22(30)24-14-18-5-4-12-31-18/h6-7,13,18H,3-5,8-12,14-15H2,1-2H3,(H,24,30)