[6-bromanyl-2-(4-tert-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: [6-bromanyl-2-(4-tert-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [6-bromo-2-(4-tert-butylphenyl)-4-quinolyl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone CAS Name: [6-bromo-2-(4-tert-butylphenyl)-4-quinolinyl]-[4-[(4-ethylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [6-bromo-2-(4-tert-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [6-bromo-2-(4-tert-butylphenyl)-4-quinolyl]-[4-(4-ethylbenzyl)piperazino]methanone Formula: C33H36BrN3O MolecularWeight: 570.56244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C33H36BrN3O/c1-5-23-6-8-24(9-7-23)22-36-16-18-37(19-17-36)32(38)29-21-31(35-30-15-14-27(34)20-28(29)30)25-10-12-26(13-11-25)33(2,3)4/h6-15,20-21H,5,16-19,22H2,1-4H3