N-[(2S)-1-[2-(1H-indol-3-ylcarbonyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-[2-(1H-indol-3-ylcarbonyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-1-[(1H-indole-3-carbonylamino)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-[[1H-indol-3-yl(oxo)methyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-[2-(1H-indole-3-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-1-[(1H-indole-3-carbonylamino)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H32N4O3 MolecularWeight: 436.54658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=O)C1=CNC2=CC=CC=C21)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=O)C1=CNC2=CC=CC=C21)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H32N4O3/c1-14(2)21(27-24(32)25-10-15-7-16(11-25)9-17(8-15)12-25)23(31)29-28-22(30)19-13-26-20-6-4-3-5-18(19)20/h3-6,13-17,21,26H,7-12H2,1-2H3,(H,27,32)(H,28,30)(H,29,31)/t15?,16?,17?,21-,25?/m0/s1