(2,5-dimethylpiperazin-1-yl)-(3-thiophen-3-ylimidazo[5,1-a]isoquinolin-6-yl)methanone

Systemtic Name: (2,5-dimethylpiperazin-1-yl)-(3-thiophen-3-ylimidazo[5,1-a]isoquinolin-6-yl)methanone Openeye Name: (2,5-dimethylpiperazin-1-yl)-[3-(3-thienyl)imidazo[5,1-a]isoquinolin-6-yl]methanone CAS Name: (2,5-dimethyl-1-piperazinyl)-[3-(3-thiophenyl)-6-imidazo[5,1-a]isoquinolinyl]methanone IUPAC Name: (2,5-dimethylpiperazin-1-yl)-(3-thiophen-3-ylimidazo[5,1-a]isoquinolin-6-yl)methanone Traditional Name: (2,5-dimethylpiperazino)-[3-(3-thienyl)imidaz[5,1-a]isoquinolin-6-yl]methanone Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC(CN1C(=O)C2=CN3C(=CN=C3C4=CSC=C4)C5=CC=CC=C52)C

Isomeric SMILES

CC1CNC(CN1C(=O)C2=CN3C(=CN=C3C4=CSC=C4)C5=CC=CC=C52)C

InChI

InChI=1S/C22H22N4OS/c1-14-11-25(15(2)9-23-14)22(27)19-12-26-20(18-6-4-3-5-17(18)19)10-24-21(26)16-7-8-28-13-16/h3-8,10,12-15,23H,9,11H2,1-2H3