N-[1-[(3-aminocarbonyl-4-fluoranyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[(3-aminocarbonyl-4-fluoranyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(3-carbamoyl-4-fluoro-phenyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-(3-carbamoyl-4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-(3-carbamoyl-4-fluoroanilino)-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[(3-carbamoyl-4-fluoro-phenyl)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C23H30FN3O3 MolecularWeight: 415.501003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30FN3O3/c1-12(2)19(21(29)26-16-3-4-18(24)17(8-16)20(25)28)27-22(30)23-9-13-5-14(10-23)7-15(6-13)11-23/h3-4,8,12-15,19H,5-7,9-11H2,1-2H3,(H2,25,28)(H,26,29)(H,27,30)