N-[(2R)-1-[2-(1H-benzimidazol-2-yl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-1-[2-(1H-benzimidazol-2-yl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-1-[2-(1H-benzimidazol-2-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-1-[2-(1H-benzimidazol-2-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=NC2=CC=CC=C2N1)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)[C@H](C(=O)NCCC1=NC2=CC=CC=C2N1)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N4O2/c1-15(2)22(23(30)26-8-7-21-27-19-5-3-4-6-20(19)28-21)29-24(31)25-12-16-9-17(13-25)11-18(10-16)14-25/h3-6,15-18,22H,7-14H2,1-2H3,(H,26,30)(H,27,28)(H,29,31)/t16?,17?,18?,22-,25?/m1/s1