4-[3-(1H-indol-3-yl)propanoyl]-N-[(2S)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-[3-(1H-indol-3-yl)propanoyl]-N-[(2S)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-[3-(1H-indol-3-yl)propanoyl]-N-[(1S)-1-methyl-2-oxo-2-(2-pyridylmethylamino)ethyl]piperazine-1-carboxamide CAS Name: 4-[3-(1H-indol-3-yl)-1-oxopropyl]-N-[(2S)-1-oxo-1-(2-pyridinylmethylamino)propan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-[3-(1H-indol-3-yl)propanoyl]-N-[(2S)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]piperazine-1-carboxamide Traditional Name: 4-[3-(1H-indol-3-yl)propanoyl]-N-[(1S)-2-keto-1-methyl-2-(2-pyridylmethylamino)ethyl]piperazine-1-carboxamide Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=N1)NC(=O)N2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=N1)NC(=O)N2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H30N6O3/c1-18(24(33)28-17-20-6-4-5-11-26-20)29-25(34)31-14-12-30(13-15-31)23(32)10-9-19-16-27-22-8-3-2-7-21(19)22/h2-8,11,16,18,27H,9-10,12-15,17H2,1H3,(H,28,33)(H,29,34)/t18-/m0/s1