N-[(2S)-1-[(3-acetamidophenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2S)-1-[(3-acetamidophenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-1-[(3-acetamidophenyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2S)-1-(3-acetamidoanilino)-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-1-(3-acetamidoanilino)-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-1-[(3-acetamidophenyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)NC(=O)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=CC(=C1)NC(=O)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H33N3O3/c1-14(2)21(22(29)26-20-6-4-5-19(10-20)25-15(3)28)27-23(30)24-11-16-7-17(12-24)9-18(8-16)13-24/h4-6,10,14,16-18,21H,7-9,11-13H2,1-3H3,(H,25,28)(H,26,29)(H,27,30)/t16?,17?,18?,21-,24?/m0/s1