4-[[2-methyl-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]propanoyl]amino]adamantane-1-carboxamide

Systemtic Name: 4-[[2-methyl-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]propanoyl]amino]adamantane-1-carboxamide Openeye Name: 4-[[2-methyl-2-[4-[(E)-2-(4-pyridyl)vinyl]phenyl]propanoyl]amino]adamantane-1-carboxamide CAS Name: 4-[[2-methyl-1-oxo-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]propyl]amino]-1-adamantanecarboxamide IUPAC Name: 4-[[2-methyl-2-[4-[(E)-2-pyridin-4-ylethenyl]phenyl]propanoyl]amino]adamantane-1-carboxamide Traditional Name: 4-[[2-methyl-2-[4-[(E)-2-(4-pyridyl)vinyl]phenyl]propanoyl]amino]adamantane-1-carboxamide Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C=CC2=CC=NC=C2)C(=O)NC3C4CC5CC3CC(C5)(C4)C(=O)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)/C=C/C2=CC=NC=C2)C(=O)NC3C4CC5CC3CC(C5)(C4)C(=O)N

InChI

InChI=1S/C28H33N3O2/c1-27(2,23-7-5-18(6-8-23)3-4-19-9-11-30-12-10-19)26(33)31-24-21-13-20-14-22(24)17-28(15-20,16-21)25(29)32/h3-12,20-22,24H,13-17H2,1-2H3,(H2,29,32)(H,31,33)/b4-3+