[2-(2-butylpyrimidin-5-yl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [2-(2-butylpyrimidin-5-yl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [2-(2-butylpyrimidin-5-yl)-4-quinolyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [2-(2-butyl-5-pyrimidinyl)-4-quinolinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [2-(2-butylpyrimidin-5-yl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [2-(2-butylpyrimidin-5-yl)-4-quinolyl]-(4-methylpiperazino)methanone Formula: C23H27N5O MolecularWeight: 389.49338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C

Isomeric SMILES

CCCCC1=NC=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C

InChI

InChI=1S/C23H27N5O/c1-3-4-9-22-24-15-17(16-25-22)21-14-19(18-7-5-6-8-20(18)26-21)23(29)28-12-10-27(2)11-13-28/h5-8,14-16H,3-4,9-13H2,1-2H3