2-[1-[2-(2-oxidanylidenepyrrolidin-1-yl)ethanoyl]piperidin-4-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[1-[2-(2-oxidanylidenepyrrolidin-1-yl)ethanoyl]piperidin-4-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[1-[2-(2-oxopyrrolidin-1-yl)acetyl]-4-piperidyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[1-[1-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]-4-piperidinyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[1-[2-(2-oxopyrrolidin-1-yl)acetyl]piperidin-4-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[1-[2-(2-ketopyrrolidino)acetyl]-4-piperidyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4CCN(CC4)C(=O)CN5CCCC5=O

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4CCN(CC4)C(=O)CN5CCCC5=O

InChI

InChI=1S/C21H26N4O3S/c26-16-6-3-9-25(16)12-17(27)24-10-7-13(8-11-24)19-22-20(28)18-14-4-1-2-5-15(14)29-21(18)23-19/h13H,1-12H2,(H,22,23,28)