N'-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]butanediamide

Systemtic Name: N'-(4-methyl-2-piperidin-1-yl-quinolin-6-yl)-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]butanediamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-N'-[4-methyl-2-(1-piperidyl)-6-quinolyl]butanediamide CAS Name: N'-[4-methyl-2-(1-piperidinyl)-6-quinolinyl]-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]butanediamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-N'-(4-methyl-2-piperidin-1-ylquinolin-6-yl)butanediamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-N'-(4-methyl-2-piperidino-6-quinolyl)succinamide Formula: C32H42N6O2 MolecularWeight: 542.71488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CCC(=O)NCCN3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C32H42N6O2/c1-25-22-30(38-15-6-3-7-16-38)35-29-11-10-27(23-28(25)29)34-32(40)13-12-31(39)33-14-17-36-18-20-37(21-19-36)24-26-8-4-2-5-9-26/h2,4-5,8-11,22-23H,3,6-7,12-21,24H2,1H3,(H,33,39)(H,34,40)