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

Systemtic Name: 4-(1H-indol-2-ylcarbonyl)-N-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1H-indole-2-carbonyl)-N-[(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: 4-[1H-indol-2-yl(oxo)methyl]-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]-1-piperazinecarboxamide IUPAC Name: 4-(1H-indole-2-carbonyl)-N-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(1H-indole-2-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=CC3=CC=CC=C3N2

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)NC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2

InChI

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