4-(1H-indol-3-ylcarbonyl)-N-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-(1H-indol-3-ylcarbonyl)-N-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1H-indole-3-carbonyl)-N-[(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: 4-[1H-indol-3-yl(oxo)methyl]-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-(1H-indole-3-carbonyl)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(1H-indole-3-carbonyl)-N-[(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl]piperazine-1-carboxamide Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)NC(=O)N1CCN(CC1)C(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)NC(=O)N1CCN(CC1)C(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C20H27N5O3/c1-13(2)22-18(26)14(3)23-20(28)25-10-8-24(9-11-25)19(27)16-12-21-17-7-5-4-6-15(16)17/h4-7,12-14,21H,8-11H2,1-3H3,(H,22,26)(H,23,28)/t14-/m0/s1