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

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-[[(1R)-1-phenylethyl]amino]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1S)-2-methyl-1-[[(1R)-1-phenylethyl]carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[[(1R)-1-phenylethyl]amino]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-[[(1R)-1-phenylethyl]amino]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1S)-2-methyl-1-[[(1R)-1-phenylethyl]carbamoyl]propyl]adamantane-1-carboxamide Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N2O2/c1-15(2)21(22(27)25-16(3)20-7-5-4-6-8-20)26-23(28)24-12-17-9-18(13-24)11-19(10-17)14-24/h4-8,15-19,21H,9-14H2,1-3H3,(H,25,27)(H,26,28)/t16-,17?,18?,19?,21+,24?/m1/s1