N-[(2R)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-1-[[(4S)-chroman-4-yl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-1-[[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-1-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-1-[[(4S)-chroman-4-yl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCOC2=CC=CC=C12)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)[C@H](C(=O)N[C@H]1CCOC2=CC=CC=C12)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O3/c1-15(2)22(23(28)26-20-7-8-30-21-6-4-3-5-19(20)21)27-24(29)25-12-16-9-17(13-25)11-18(10-16)14-25/h3-6,15-18,20,22H,7-14H2,1-2H3,(H,26,28)(H,27,29)/t16?,17?,18?,20-,22+,25?/m0/s1