3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-[2-(4-pyridyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-(2-pyridin-4-yl-1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-1-(2-pyridin-4-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-1-[2-(4-pyridyl)pyrrolidino]propan-1-one Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCCC2C3=CC=NC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N2CCCC2C3=CC=NC=C3

InChI

InChI=1S/C19H24N4OS/c1-13-16(14(2)22-19(21-13)25-3)6-7-18(24)23-12-4-5-17(23)15-8-10-20-11-9-15/h8-11,17H,4-7,12H2,1-3H3