2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-[2-oxo-2-(1-piperidyl)ethyl]-1H-pyrimidin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-methyl-5-[2-oxo-2-(1-piperidinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-5-(2-oxo-2-piperidin-1-ylethyl)-1H-pyrimidin-4-one Traditional Name: 5-(2-keto-2-piperidino-ethyl)-2-(m-anisylthio)-6-methyl-1H-pyrimidin-4-one Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)N3CCCCC3

InChI

InChI=1S/C20H25N3O3S/c1-14-17(12-18(24)23-9-4-3-5-10-23)19(25)22-20(21-14)27-13-15-7-6-8-16(11-15)26-2/h6-8,11H,3-5,9-10,12-13H2,1-2H3,(H,21,22,25)