3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)N3CCCC3)C4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)N3CCCC3)C4=CC(=C(C=C4)C)C)C

InChI

InChI=1S/C24H29N3O2S2/c1-6-19-16(4)30-21-20(19)23(29)27(18-10-9-14(2)15(3)13-18)24(25-21)31-17(5)22(28)26-11-7-8-12-26/h9-10,13,17H,6-8,11-12H2,1-5H3