N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)piperazin-1-yl]-quinolin-8-yl-methyl]benzamide

Systemtic Name: N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)piperazin-1-yl]-quinolin-8-yl-methyl]benzamide Openeye Name: N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)piperazin-1-yl]-(8-quinolyl)methyl]benzamide CAS Name: N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)-1-piperazinyl]-(8-quinolinyl)methyl]benzamide IUPAC Name: N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)piperazin-1-yl]-quinolin-8-ylmethyl]benzamide Traditional Name: N,N-diethyl-4-[[4-(1H-imidazol-5-ylmethyl)piperazino]-(8-quinolyl)methyl]benzamide Formula: C29H34N6O MolecularWeight: 482.61986

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC3=C2N=CC=C3)N4CCN(CC4)CC5=CN=CN5

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC3=C2N=CC=C3)N4CCN(CC4)CC5=CN=CN5

InChI

InChI=1S/C29H34N6O/c1-3-34(4-2)29(36)24-12-10-23(11-13-24)28(26-9-5-7-22-8-6-14-31-27(22)26)35-17-15-33(16-18-35)20-25-19-30-21-32-25/h5-14,19,21,28H,3-4,15-18,20H2,1-2H3,(H,30,32)