2-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(azepan-1-ylcarbonyl)piperidin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[4-(azepane-1-carbonyl)-1-piperidyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[4-(azepane-1-carbonyl)piperidin-1-yl]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[4-(azepane-1-carbonyl)piperidino]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C19H26N4O2S MolecularWeight: 374.50034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)CC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C19H26N4O2S/c24-18-17-15(7-12-26-17)20-16(21-18)13-22-10-5-14(6-11-22)19(25)23-8-3-1-2-4-9-23/h7,12,14H,1-6,8-11,13H2,(H,20,21,24)