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

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)-1H-pyrimidin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-(2-oxo-2-pyrrolidin-1-ylethyl)-1H-pyrimidin-4-one Traditional Name: 6-(2-keto-2-pyrrolidino-ethyl)-2-(m-anisylthio)-1H-pyrimidin-4-one Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC(=O)C=C(N2)CC(=O)N3CCCC3

InChI

InChI=1S/C18H21N3O3S/c1-24-15-6-4-5-13(9-15)12-25-18-19-14(10-16(22)20-18)11-17(23)21-7-2-3-8-21/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,19,20,22)