N-[4-[2-[[3-(4-cyclopentylpiperazin-1-yl)carbonylphenyl]amino]pyrimidin-4-yl]phenyl]ethanamide

Systemtic Name: N-[4-[2-[[3-(4-cyclopentylpiperazin-1-yl)carbonylphenyl]amino]pyrimidin-4-yl]phenyl]ethanamide Openeye Name: N-[4-[2-[3-(4-cyclopentylpiperazine-1-carbonyl)anilino]pyrimidin-4-yl]phenyl]acetamide CAS Name: N-[4-[2-[3-[(4-cyclopentyl-1-piperazinyl)-oxomethyl]anilino]-4-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[4-[2-[3-(4-cyclopentylpiperazine-1-carbonyl)anilino]pyrimidin-4-yl]phenyl]acetamide Traditional Name: N-[4-[2-[3-(4-cyclopentylpiperazine-1-carbonyl)anilino]pyrimidin-4-yl]phenyl]acetamide Formula: C28H32N6O2 MolecularWeight: 484.59268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5CCCC5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C5CCCC5

InChI

InChI=1S/C28H32N6O2/c1-20(35)30-23-11-9-21(10-12-23)26-13-14-29-28(32-26)31-24-6-4-5-22(19-24)27(36)34-17-15-33(16-18-34)25-7-2-3-8-25/h4-6,9-14,19,25H,2-3,7-8,15-18H2,1H3,(H,30,35)(H,29,31,32)