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

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-butoxy-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-butoxy-benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-4-butoxybenzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-butoxybenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-4-butoxy-benzamide Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCCOC2=NC=NC(=C2)N3CCCCCC3

InChI

InChI=1S/C23H32N4O3/c1-2-3-15-29-20-10-8-19(9-11-20)23(28)24-12-16-30-22-17-21(25-18-26-22)27-13-6-4-5-7-14-27/h8-11,17-18H,2-7,12-16H2,1H3,(H,24,28)