2-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl-methyl-amino]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(3-chloranyl-4-methyl-quinolin-2-yl)methyl-methyl-amino]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[(3-chloro-4-methyl-2-quinolyl)methyl-methyl-amino]ethanone CAS Name: 2-[(3-chloro-4-methyl-2-quinolinyl)methyl-methylamino]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[(3-chloro-4-methylquinolin-2-yl)methyl-methylamino]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[(3-chloro-4-methyl-2-quinolyl)methyl-methyl-amino]ethanone Formula: C25H29ClN4O MolecularWeight: 436.97696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN(C)CC(=O)N3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H29ClN4O/c1-19-21-10-6-7-11-22(21)27-23(25(19)26)17-28(2)18-24(31)30-14-12-29(13-15-30)16-20-8-4-3-5-9-20/h3-11H,12-18H2,1-2H3