3-[[3-(4-ethanoylpiperazin-1-yl)carbonylphenyl]amino]-2-propyl-3H-isoindol-1-one

Systemtic Name: 3-[[3-(4-ethanoylpiperazin-1-yl)carbonylphenyl]amino]-2-propyl-3H-isoindol-1-one Openeye Name: 3-[3-(4-acetylpiperazine-1-carbonyl)anilino]-2-propyl-isoindolin-1-one CAS Name: 3-[3-[(4-acetyl-1-piperazinyl)-oxomethyl]anilino]-2-propyl-3H-isoindol-1-one IUPAC Name: 3-[3-(4-acetylpiperazine-1-carbonyl)anilino]-2-propyl-3H-isoindol-1-one Traditional Name: 3-[3-(4-acetylpiperazine-1-carbonyl)anilino]-2-propyl-isoindolin-1-one Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

CCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C24H28N4O3/c1-3-11-28-22(20-9-4-5-10-21(20)24(28)31)25-19-8-6-7-18(16-19)23(30)27-14-12-26(13-15-27)17(2)29/h4-10,16,22,25H,3,11-15H2,1-2H3