6-oxidanyl-4-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-oxidanyl-4-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-hydroxy-4-[[5-(1-piperidylmethyl)-2-thienyl]methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 6-hydroxy-4-[[5-(1-piperidinylmethyl)-2-thiophenyl]methyl]-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-hydroxy-4-[[5-(piperidin-1-ylmethyl)thiophen-2-yl]methyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-hydroxy-4-[[5-(piperidinomethyl)-2-thienyl]methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C22H30N4O2S MolecularWeight: 414.5642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(S2)CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(S2)CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

InChI

InChI=1S/C22H30N4O2S/c27-19-13-25(17-22(28)26(14-19)12-18-5-4-8-23-11-18)16-21-7-6-20(29-21)15-24-9-2-1-3-10-24/h4-8,11,19,27H,1-3,9-10,12-17H2