3-[3-(azepan-1-yl)propyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[3-(azepan-1-yl)propyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[3-(azepan-1-yl)propyl]-2-thioxo-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[3-(1-azepanyl)propyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 3-[3-(azepan-1-yl)propyl]-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[3-(azepan-1-yl)propyl]-2-thioxo-1H-thieno[3,2-d]pyrimidin-4-one Formula: C15H21N3OS2 MolecularWeight: 323.47674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCN2C(=O)C3=C(C=CS3)NC2=S

Isomeric SMILES

C1CCCN(CC1)CCCN2C(=O)C3=C(C=CS3)NC2=S

InChI

InChI=1S/C15H21N3OS2/c19-14-13-12(6-11-21-13)16-15(20)18(14)10-5-9-17-7-3-1-2-4-8-17/h6,11H,1-5,7-10H2,(H,16,20)