N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[1-(2-pyridinyl)cyclohexyl]methylamino]propan-2-yl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[(1-pyridin-2-ylcyclohexyl)methylamino]propan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-[[1-(2-pyridyl)cyclohexyl]methylamino]ethyl]-5-methyl-isoxazole-3-carboxamide Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC(C)(CC2=CNC3=CC=CC=C32)C(=O)NCC4(CCCCC4)C5=CC=CC=N5

Isomeric SMILES

CC1=CC(=NO1)C(=O)N[C@@](C)(CC2=CNC3=CC=CC=C32)C(=O)NCC4(CCCCC4)C5=CC=CC=N5

InChI

InChI=1S/C29H33N5O3/c1-20-16-24(34-37-20)26(35)33-28(2,17-21-18-31-23-11-5-4-10-22(21)23)27(36)32-19-29(13-7-3-8-14-29)25-12-6-9-15-30-25/h4-6,9-12,15-16,18,31H,3,7-8,13-14,17,19H2,1-2H3,(H,32,36)(H,33,35)/t28-/m0/s1