(2,3-diethylquinoxalin-6-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (2,3-diethylquinoxalin-6-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (2,3-diethylquinoxalin-6-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2,3-diethyl-6-quinoxalinyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (2,3-diethylquinoxalin-6-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (2,3-diethylquinoxalin-6-yl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C26H32N4O MolecularWeight: 416.55848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCCN(CC3)CC4=CC=C(C=C4)C)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)N3CCCN(CC3)CC4=CC=C(C=C4)C)N=C1CC

InChI

InChI=1S/C26H32N4O/c1-4-22-23(5-2)28-25-17-21(11-12-24(25)27-22)26(31)30-14-6-13-29(15-16-30)18-20-9-7-19(3)8-10-20/h7-12,17H,4-6,13-16,18H2,1-3H3