2-[[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-(phenylmethyl)amino]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[(6-bromanyl-2-methoxy-quinolin-3-yl)-phenyl-methyl]-(phenylmethyl)amino]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[benzyl-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]amino]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[(6-bromo-2-methoxy-3-quinolinyl)-phenylmethyl]-(phenylmethyl)amino]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[benzyl-[(6-bromo-2-methoxyquinolin-3-yl)-phenylmethyl]amino]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[benzyl-[(6-bromo-2-methoxy-3-quinolyl)-phenyl-methyl]amino]-1-(4-methylpiperazino)ethanone Formula: C31H33BrN4O2 MolecularWeight: 573.52332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC

InChI

InChI=1S/C31H33BrN4O2/c1-34-15-17-35(18-16-34)29(37)22-36(21-23-9-5-3-6-10-23)30(24-11-7-4-8-12-24)27-20-25-19-26(32)13-14-28(25)33-31(27)38-2/h3-14,19-20,30H,15-18,21-22H2,1-2H3