3-methyl-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-[[4-(pyrrolidine-1-carbonyl)benzyl]thio]thieno[2,3-d]pyrimidin-4-one Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4)SC=C2

InChI

InChI=1S/C19H19N3O2S2/c1-21-18(24)15-8-11-25-16(15)20-19(21)26-12-13-4-6-14(7-5-13)17(23)22-9-2-3-10-22/h4-8,11H,2-3,9-10,12H2,1H3