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

Systemtic Name: (6-chloranyl-2-methyl-quinolin-3-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (6-chloro-2-methyl-3-quinolyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (6-chloro-2-methyl-3-quinolinyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (6-chloro-2-methylquinolin-3-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (6-chloro-2-methyl-3-quinolyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C24H26ClN3O MolecularWeight: 407.93574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=C(N=C4C=CC(=CC4=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=C(N=C4C=CC(=CC4=C3)Cl)C

InChI

InChI=1S/C24H26ClN3O/c1-17-4-6-19(7-5-17)16-27-10-3-11-28(13-12-27)24(29)22-15-20-14-21(25)8-9-23(20)26-18(22)2/h4-9,14-15H,3,10-13,16H2,1-2H3