1-[3-[3-(azepan-1-ylcarbonyl)pyridin-2-yl]oxyphenyl]-3-propan-2-yl-urea

Systemtic Name: 1-[3-[3-(azepan-1-ylcarbonyl)pyridin-2-yl]oxyphenyl]-3-propan-2-yl-urea Openeye Name: 1-[3-[[3-(azepane-1-carbonyl)-2-pyridyl]oxy]phenyl]-3-isopropyl-urea CAS Name: 1-[3-[[3-[1-azepanyl(oxo)methyl]-2-pyridinyl]oxy]phenyl]-3-propan-2-ylurea IUPAC Name: 1-[3-[3-(azepane-1-carbonyl)pyridin-2-yl]oxyphenyl]-3-propan-2-ylurea Traditional Name: 1-[3-[[3-(azepane-1-carbonyl)-2-pyridyl]oxy]phenyl]-3-isopropyl-urea Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC(=CC=C1)OC2=C(C=CC=N2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)NC(=O)NC1=CC(=CC=C1)OC2=C(C=CC=N2)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N4O3/c1-16(2)24-22(28)25-17-9-7-10-18(15-17)29-20-19(11-8-12-23-20)21(27)26-13-5-3-4-6-14-26/h7-12,15-16H,3-6,13-14H2,1-2H3,(H2,24,25,28)