(2S,4S)-4-azanyl-N-[(2S)-1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-pyrazin-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2S,4S)-4-azanyl-N-[(2S)-1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-pyrazin-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2S,4S)-4-amino-N-[(1S)-2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-1-(pyrazine-2-carbonyl)piperidine-2-carboxamide CAS Name: (2S,4S)-4-amino-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-[oxo(2-pyrazinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2S,4S)-4-amino-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-(pyrazine-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2S,4S)-4-amino-N-[(1S)-2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-1-pyrazinoyl-pipecolinamide Formula: C22H25N7O3 MolecularWeight: 435.479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CC1N)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1CN([C@@H](C[C@H]1N)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)N)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C22H25N7O3/c23-14-5-8-29(22(32)18-12-25-6-7-26-18)19(10-14)21(31)28-17(20(24)30)9-13-11-27-16-4-2-1-3-15(13)16/h1-4,6-7,11-12,14,17,19,27H,5,8-10,23H2,(H2,24,30)(H,28,31)/t14-,17-,19-/m0/s1