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

Systemtic Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-(2-chlorophenyl)urea Openeye Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-(2-chlorophenyl)urea CAS Name: 1-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-3-(2-chlorophenyl)urea IUPAC Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-(2-chlorophenyl)urea Traditional Name: 1-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3-(2-chlorophenyl)urea Formula: C19H24ClN5O2 MolecularWeight: 389.87916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C19H24ClN5O2/c20-15-7-3-4-8-16(15)24-19(26)21-9-12-27-18-13-17(22-14-23-18)25-10-5-1-2-6-11-25/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H2,21,24,26)