6-methyl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 6-methyl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-6-methyl-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrimidin-4-one CAS Name: 6-methyl-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 2-benzylsulfanyl-6-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimidin-4-one Traditional Name: 2-(benzylthio)-3-(2-keto-2-pyrrolidino-ethyl)-6-methyl-pyrimidin-4-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC(=O)N3CCCC3

InChI

InChI=1S/C18H21N3O2S/c1-14-11-16(22)21(12-17(23)20-9-5-6-10-20)18(19-14)24-13-15-7-3-2-4-8-15/h2-4,7-8,11H,5-6,9-10,12-13H2,1H3