[2-[1-(2-hydroxyethyl)pyrazol-4-yl]-8-methyl-quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [2-[1-(2-hydroxyethyl)pyrazol-4-yl]-8-methyl-quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [2-[1-(2-hydroxyethyl)pyrazol-4-yl]-8-methyl-4-quinolyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [2-[1-(2-hydroxyethyl)-4-pyrazolyl]-8-methyl-4-quinolinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [2-[1-(2-hydroxyethyl)pyrazol-4-yl]-8-methylquinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [2-[1-(2-hydroxyethyl)pyrazol-4-yl]-8-methyl-4-quinolyl]-(4-methylpiperazino)methanone Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)C)C4=CN(N=C4)CCO

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)C)C4=CN(N=C4)CCO

InChI

InChI=1S/C21H25N5O2/c1-15-4-3-5-17-18(21(28)25-8-6-24(2)7-9-25)12-19(23-20(15)17)16-13-22-26(14-16)10-11-27/h3-5,12-14,27H,6-11H2,1-2H3