7-[(2-pyridin-4-ylazepan-1-yl)methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(2-pyridin-4-ylazepan-1-yl)methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[[2-(4-pyridyl)azepan-1-yl]methyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[(2-pyridin-4-yl-1-azepanyl)methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(2-pyridin-4-ylazepan-1-yl)methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[2-(4-pyridyl)azepan-1-yl]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)CC2=CC(=O)N3C=CSC3=N2)C4=CC=NC=C4

Isomeric SMILES

C1CCC(N(CC1)CC2=CC(=O)N3C=CSC3=N2)C4=CC=NC=C4

InChI

InChI=1S/C18H20N4OS/c23-17-12-15(20-18-22(17)10-11-24-18)13-21-9-3-1-2-4-16(21)14-5-7-19-8-6-14/h5-8,10-12,16H,1-4,9,13H2