(5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(2-pyridin-4-ylcarbonylhydrazinyl)ethyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-[2-oxidanylidene-2-(2-pyridin-4-ylcarbonylhydrazinyl)ethyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazino]ethyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[2-oxo-2-[[oxo(pyridin-4-yl)methyl]hydrazo]ethyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[2-(N'-isonicotinoylhydrazino)-2-keto-ethyl]adamantane-1-carboxamide Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCC(=O)NNC(=O)C4=CC=NC=C4

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)Cl)C(=O)NCC(=O)NNC(=O)C4=CC=NC=C4

InChI

InChI=1S/C19H23ClN4O3/c20-19-8-12-5-13(9-19)7-18(6-12,11-19)17(27)22-10-15(25)23-24-16(26)14-1-3-21-4-2-14/h1-4,12-13H,5-11H2,(H,22,27)(H,23,25)(H,24,26)/t12-,13+,18?,19?