(2-cyclopropylquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-cyclopropylquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (2-cyclopropyl-4-quinolyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (2-cyclopropyl-4-quinolinyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-cyclopropylquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (2-cyclopropyl-4-quinolyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C21H21N5O/c27-20(25-10-12-26(13-11-25)21-22-8-3-9-23-21)17-14-19(15-6-7-15)24-18-5-2-1-4-16(17)18/h1-5,8-9,14-15H,6-7,10-13H2