4-(12-azanyldodecylamino)-1-[5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

Systemtic Name: 4-(12-azanyldodecylamino)-1-[5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Openeye Name: 4-(12-aminododecylamino)-1-[5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one CAS Name: 4-(12-aminododecylamino)-1-[5-(hydroxymethyl)-2-oxolanyl]-2-pyrimidinone IUPAC Name: 4-(12-aminododecylamino)-1-[5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Traditional Name: 4-(12-aminododecylamino)-1-(5-methyloltetrahydrofuran-2-yl)pyrimidin-2-one Formula: C21H38N4O3 MolecularWeight: 394.55142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CO)N2C=CC(=NC2=O)NCCCCCCCCCCCCN

Isomeric SMILES

C1CC(OC1CO)N2C=CC(=NC2=O)NCCCCCCCCCCCCN

InChI

InChI=1S/C21H38N4O3/c22-14-9-7-5-3-1-2-4-6-8-10-15-23-19-13-16-25(21(27)24-19)20-12-11-18(17-26)28-20/h13,16,18,20,26H,1-12,14-15,17,22H2,(H,23,24,27)