2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-hexyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-5-hexyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-5-hexyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-5-hexyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-5-hexyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[4-(2-furoyl)piperazino]-5-hexyl-6-methyl-1H-pyrimidin-4-one Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=NC1=O)N2CCN(CC2)C(=O)C3=CC=CO3)C

Isomeric SMILES

CCCCCCC1=C(NC(=NC1=O)N2CCN(CC2)C(=O)C3=CC=CO3)C

InChI

InChI=1S/C20H28N4O3/c1-3-4-5-6-8-16-15(2)21-20(22-18(16)25)24-12-10-23(11-13-24)19(26)17-9-7-14-27-17/h7,9,14H,3-6,8,10-13H2,1-2H3,(H,21,22,25)