2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(2-methyl-4-quinolyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-(2-methyl-4-quinolinyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(2-methylquinolin-4-yl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(2-methyl-4-quinolyl)piperazino]benzonitrile Formula: C21H20N4 MolecularWeight: 328.4103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)N3CCN(CC3)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)N3CCN(CC3)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H20N4/c1-16-14-21(18-7-3-4-8-19(18)23-16)25-12-10-24(11-13-25)20-9-5-2-6-17(20)15-22/h2-9,14H,10-13H2,1H3