2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]propanamide

Systemtic Name: 2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]propanamide Openeye Name: 2-methyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzofuran-3-yl]propanamide CAS Name: 2-methyl-N-[2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-3-benzofuranyl]propanamide IUPAC Name: 2-methyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-benzofuran-3-yl]propanamide Traditional Name: 2-methyl-N-[2-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzofuran-3-yl]propionamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O3/c1-14(2)19(27)24-17-15-6-3-4-7-16(15)29-18(17)20(28)25-10-12-26(13-11-25)21-22-8-5-9-23-21/h3-9,14H,10-13H2,1-2H3,(H,24,27)