1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-urea

Systemtic Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-urea Openeye Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-urea CAS Name: 1-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-3-phenylurea IUPAC Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenylurea Traditional Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-phenyl-urea Formula: C19H25N5O2 MolecularWeight: 355.4341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H25N5O2/c25-19(23-16-8-4-3-5-9-16)20-10-13-26-18-14-17(21-15-22-18)24-11-6-1-2-7-12-24/h3-5,8-9,14-15H,1-2,6-7,10-13H2,(H2,20,23,25)