2-[4-[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonyl-1,4-diazepan-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-[2-(2,4-dimethylphenyl)quinolin-4-yl]carbonyl-1,4-diazepan-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]-1,4-diazepan-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-[[2-(2,4-dimethylphenyl)-4-quinolinyl]-oxomethyl]-1,4-diazepan-1-yl]-N,N-diethylacetamide IUPAC Name: 2-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]-1,4-diazepan-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-[2-(2,4-dimethylphenyl)quinoline-4-carbonyl]-1,4-diazepan-1-yl]-N,N-diethyl-acetamide Formula: C29H36N4O2 MolecularWeight: 472.62174

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)C)C

Isomeric SMILES

CCN(CC)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=C(C=C4)C)C

InChI

InChI=1S/C29H36N4O2/c1-5-32(6-2)28(34)20-31-14-9-15-33(17-16-31)29(35)25-19-27(23-13-12-21(3)18-22(23)4)30-26-11-8-7-10-24(25)26/h7-8,10-13,18-19H,5-6,9,14-17,20H2,1-4H3