2-propyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]pentanamide

Systemtic Name: 2-propyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]pentanamide Openeye Name: 2-propyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzofuran-3-yl]pentanamide CAS Name: N-[2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3-benzofuranyl]-2-propylpentanamide IUPAC Name: 2-propyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-benzofuran-3-yl]pentanamide Traditional Name: 2-propyl-N-[2-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzofuran-3-yl]valeramide Formula: C25H31N5O3 MolecularWeight: 449.54534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCCC(CCC)C(=O)NC1=C(OC2=CC=CC=C21)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C25H31N5O3/c1-3-8-18(9-4-2)23(31)28-21-19-10-5-6-11-20(19)33-22(21)24(32)29-14-16-30(17-15-29)25-26-12-7-13-27-25/h5-7,10-13,18H,3-4,8-9,14-17H2,1-2H3,(H,28,31)