N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,4-diethoxy-benzamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,4-diethoxy-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,4-diethoxy-benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-3,4-diethoxybenzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,4-diethoxybenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-3,4-diethoxy-benzamide Formula: C23H32N4O4 MolecularWeight: 428.52458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3)OCC

InChI

InChI=1S/C23H32N4O4/c1-3-29-19-10-9-18(15-20(19)30-4-2)23(28)24-11-14-31-22-16-21(25-17-26-22)27-12-7-5-6-8-13-27/h9-10,15-17H,3-8,11-14H2,1-2H3,(H,24,28)