2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxoazepan-3-yl]benzamide CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-N-[(3S)-2-oxo-3-azepanyl]benzamide IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-oxoazepan-3-yl]benzamide Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-N-[(3S)-2-ketoazepan-3-yl]benzamide Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)NC3CCCCNC3=O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)N[C@H]3CCCCNC3=O)OC

InChI

InChI=1S/C19H22N4O5/c1-26-15-11-16(27-2)23-19(22-15)28-14-9-4-3-7-12(14)17(24)21-13-8-5-6-10-20-18(13)25/h3-4,7,9,11,13H,5-6,8,10H2,1-2H3,(H,20,25)(H,21,24)/t13-/m0/s1