3-ethanoyl-1-[3-(methylamino)propyl]-7-[[(1-methylimidazol-2-yl)amino]methyl]quinolin-4-one

Systemtic Name: 3-ethanoyl-1-[3-(methylamino)propyl]-7-[[(1-methylimidazol-2-yl)amino]methyl]quinolin-4-one Openeye Name: 3-acetyl-1-[3-(methylamino)propyl]-7-[[(1-methylimidazol-2-yl)amino]methyl]quinolin-4-one CAS Name: 3-acetyl-1-[3-(methylamino)propyl]-7-[[(1-methyl-2-imidazolyl)amino]methyl]-4-quinolinone IUPAC Name: 3-acetyl-1-[3-(methylamino)propyl]-7-[[(1-methylimidazol-2-yl)amino]methyl]quinolin-4-one Traditional Name: 3-acetyl-1-[3-(methylamino)propyl]-7-[[(1-methylimidazol-2-yl)amino]methyl]-4-quinolone Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)CNC3=NC=CN3C)CCCNC

Isomeric SMILES

CC(=O)C1=CN(C2=C(C1=O)C=CC(=C2)CNC3=NC=CN3C)CCCNC

InChI

InChI=1S/C20H25N5O2/c1-14(26)17-13-25(9-4-7-21-2)18-11-15(5-6-16(18)19(17)27)12-23-20-22-8-10-24(20)3/h5-6,8,10-11,13,21H,4,7,9,12H2,1-3H3,(H,22,23)