3-[(4-pyrrolidin-1-ylcarbonylcyclohexyl)methyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[(4-pyrrolidin-1-ylcarbonylcyclohexyl)methyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[[4-(pyrrolidine-1-carbonyl)cyclohexyl]methyl]-2-thioxo-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[[4-[oxo(1-pyrrolidinyl)methyl]cyclohexyl]methyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 3-[[4-(pyrrolidine-1-carbonyl)cyclohexyl]methyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[[4-(pyrrolidine-1-carbonyl)cyclohexyl]methyl]-2-thioxo-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H23N3O2S2 MolecularWeight: 377.52412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCC(CC2)CN3C(=O)C4=C(C=CS4)NC3=S

Isomeric SMILES

C1CCN(C1)C(=O)C2CCC(CC2)CN3C(=O)C4=C(C=CS4)NC3=S

InChI

InChI=1S/C18H23N3O2S2/c22-16(20-8-1-2-9-20)13-5-3-12(4-6-13)11-21-17(23)15-14(7-10-25-15)19-18(21)24/h7,10,12-13H,1-6,8-9,11H2,(H,19,24)