N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-octyl]-3-(4-methylpiperazin-1-yl)propanamide

Systemtic Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-octyl]-3-(4-methylpiperazin-1-yl)propanamide Openeye Name: N-[(1S)-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]-7-oxo-octyl]-3-(4-methylpiperazin-1-yl)propanamide CAS Name: N-[(1S)-1-[5-(4-methoxy-2-quinolinyl)-1H-imidazol-2-yl]-7-oxooctyl]-3-(4-methyl-1-piperazinyl)propanamide IUPAC Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxooctyl]-3-(4-methylpiperazin-1-yl)propanamide Traditional Name: N-[(1S)-7-keto-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]octyl]-3-(4-methylpiperazino)propionamide Formula: C29H40N6O3 MolecularWeight: 520.6663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCC(C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)CCN4CCN(CC4)C

Isomeric SMILES

CC(=O)CCCCC[C@@H](C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)CCN4CCN(CC4)C

InChI

InChI=1S/C29H40N6O3/c1-21(36)9-5-4-6-12-24(32-28(37)13-14-35-17-15-34(2)16-18-35)29-30-20-26(33-29)25-19-27(38-3)22-10-7-8-11-23(22)31-25/h7-8,10-11,19-20,24H,4-6,9,12-18H2,1-3H3,(H,30,33)(H,32,37)/t24-/m0/s1