5-[[4-ethyl-6-(2-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)furan-2-carboxamide

Systemtic Name: 5-[[4-ethyl-6-(2-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(phenylmethyl)furan-2-carboxamide Openeye Name: N-benzyl-5-[[4-ethyl-6-(2-methyl-1-piperidyl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide CAS Name: 5-[[[4-ethyl-6-(2-methyl-1-piperidinyl)-2-pyrimidinyl]thio]methyl]-N-(phenylmethyl)-2-furancarboxamide IUPAC Name: N-benzyl-5-[[4-ethyl-6-(2-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylmethyl]furan-2-carboxamide Traditional Name: N-benzyl-5-[[[4-ethyl-6-(2-methylpiperidino)pyrimidin-2-yl]thio]methyl]-2-furamide Formula: C25H30N4O2S MolecularWeight: 450.5963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=C3)N4CCCCC4C

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(O2)C(=O)NCC3=CC=CC=C3)N4CCCCC4C

InChI

InChI=1S/C25H30N4O2S/c1-3-20-15-23(29-14-8-7-9-18(29)2)28-25(27-20)32-17-21-12-13-22(31-21)24(30)26-16-19-10-5-4-6-11-19/h4-6,10-13,15,18H,3,7-9,14,16-17H2,1-2H3,(H,26,30)