N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-bromanyl-benzamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-bromanyl-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-bromo-benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-bromobenzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-bromobenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-bromo-benzamide Formula: C19H23BrN4O2 MolecularWeight: 419.31552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN4O2/c20-16-7-5-15(6-8-16)19(25)21-9-12-26-18-13-17(22-14-23-18)24-10-3-1-2-4-11-24/h5-8,13-14H,1-4,9-12H2,(H,21,25)