N-[2-(1,7-diphenylheptan-4-ylamino)-2-oxidanylidene-ethyl]-N-methyl-2-[4-(2-oxidanyl-3-quinolin-5-yloxy-propyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[2-(1,7-diphenylheptan-4-ylamino)-2-oxidanylidene-ethyl]-N-methyl-2-[4-(2-oxidanyl-3-quinolin-5-yloxy-propyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-hydroxy-3-(5-quinolyloxy)propyl]piperazin-1-yl]-N-methyl-N-[2-oxo-2-[[4-phenyl-1-(3-phenylpropyl)butyl]amino]ethyl]acetamide CAS Name: N-[2-(1,7-diphenylheptan-4-ylamino)-2-oxoethyl]-2-[4-[2-hydroxy-3-(5-quinolinyloxy)propyl]-1-piperazinyl]-N-methylacetamide IUPAC Name: N-[2-(1,7-diphenylheptan-4-ylamino)-2-oxoethyl]-2-[4-(2-hydroxy-3-quinolin-5-yloxypropyl)piperazin-1-yl]-N-methylacetamide Traditional Name: 2-[4-[2-hydroxy-3-(5-quinolyloxy)propyl]piperazino]-N-[2-keto-2-[[4-phenyl-1-(3-phenylpropyl)butyl]amino]ethyl]-N-methyl-acetamide Formula: C40H51N5O4 MolecularWeight: 665.86404

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2)C(=O)CN3CCN(CC3)CC(COC4=CC=CC5=C4C=CC=N5)O

Isomeric SMILES

CN(CC(=O)NC(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2)C(=O)CN3CCN(CC3)CC(COC4=CC=CC5=C4C=CC=N5)O

InChI

InChI=1S/C40H51N5O4/c1-43(29-39(47)42-34(18-8-16-32-12-4-2-5-13-32)19-9-17-33-14-6-3-7-15-33)40(48)30-45-26-24-44(25-27-45)28-35(46)31-49-38-22-10-21-37-36(38)20-11-23-41-37/h2-7,10-15,20-23,34-35,46H,8-9,16-19,24-31H2,1H3,(H,42,47)