N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]quinoline-8-carboxamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]quinoline-8-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]quinoline-8-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[1-(2-pyridinyl)cyclohexyl]methylamino]propan-2-yl]-8-quinolinecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]quinoline-8-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]quinoline-8-carboxamide Formula: C34H35N5O2 MolecularWeight: 545.674

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCC3(CCCCC3)C4=CC=CC=N4)NC(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C[C@](CC1=CNC2=CC=CC=C21)(C(=O)NCC3(CCCCC3)C4=CC=CC=N4)NC(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C34H35N5O2/c1-33(21-25-22-37-28-15-4-3-13-26(25)28,39-31(40)27-14-9-11-24-12-10-20-36-30(24)27)32(41)38-23-34(17-6-2-7-18-34)29-16-5-8-19-35-29/h3-5,8-16,19-20,22,37H,2,6-7,17-18,21,23H2,1H3,(H,38,41)(H,39,40)/t33-/m0/s1