N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-ethoxy-naphthalene-1-carboxamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-ethoxy-naphthalene-1-carboxamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-ethoxy-naphthalene-1-carboxamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-ethoxy-1-naphthalenecarboxamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-ethoxynaphthalene-1-carboxamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-ethoxy-1-naphthamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NCCOC3=NC=NC(=C3)N4CCCCCC4

InChI

InChI=1S/C25H30N4O3/c1-2-31-21-12-11-19-9-5-6-10-20(19)24(21)25(30)26-13-16-32-23-17-22(27-18-28-23)29-14-7-3-4-8-15-29/h5-6,9-12,17-18H,2-4,7-8,13-16H2,1H3,(H,26,30)