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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-1-[2-(3-thienyl)pyrrolidin-1-yl]propan-1-one CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-[2-(3-thiophenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-1-[2-(3-thienyl)pyrrolidino]propan-1-one Formula: C18H23N3OS2 MolecularWeight: 361.52472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3OS2/c1-12-15(13(2)20-18(19-12)23-3)6-7-17(22)21-9-4-5-16(21)14-8-10-24-11-14/h8,10-11,16H,4-7,9H2,1-3H3