1-cycloheptyl-3-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]urea

Systemtic Name: 1-cycloheptyl-3-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]urea Openeye Name: 1-cycloheptyl-3-[(E)-4-[[4-(1-piperidylmethyl)-2-pyridyl]oxy]but-2-enyl]urea CAS Name: 1-cycloheptyl-3-[(E)-4-[[4-(1-piperidinylmethyl)-2-pyridinyl]oxy]but-2-enyl]urea IUPAC Name: 1-cycloheptyl-3-[(E)-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]oxybut-2-enyl]urea Traditional Name: 1-cycloheptyl-3-[(E)-4-[[4-(piperidinomethyl)-2-pyridyl]oxy]but-2-enyl]urea Formula: C23H36N4O2 MolecularWeight: 400.55754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)NCC=CCOC2=NC=CC(=C2)CN3CCCCC3

Isomeric SMILES

C1CCCC(CC1)NC(=O)NC/C=C/COC2=NC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C23H36N4O2/c28-23(26-21-10-4-1-2-5-11-21)25-13-6-9-17-29-22-18-20(12-14-24-22)19-27-15-7-3-8-16-27/h6,9,12,14,18,21H,1-5,7-8,10-11,13,15-17,19H2,(H2,25,26,28)/b9-6+