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

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]quinoxaline-2-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[1-(2-pyridinyl)cyclohexyl]methylamino]propan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]quinoxaline-2-carboxamide Formula: C33H34N6O2 MolecularWeight: 546.66206

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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=NC6=CC=CC=C6N=C5

Isomeric SMILES

C[C@](CC1=CNC2=CC=CC=C21)(C(=O)NCC3(CCCCC3)C4=CC=CC=N4)NC(=O)C5=NC6=CC=CC=C6N=C5

InChI

InChI=1S/C33H34N6O2/c1-32(19-23-20-35-25-12-4-3-11-24(23)25,39-30(40)28-21-36-26-13-5-6-14-27(26)38-28)31(41)37-22-33(16-8-2-9-17-33)29-15-7-10-18-34-29/h3-7,10-15,18,20-21,35H,2,8-9,16-17,19,22H2,1H3,(H,37,41)(H,39,40)/t32-/m0/s1