N-(1-adamantylmethyl)-6-chloranyl-2-[4-(5-oxidanylidene-2H-1,2,4-oxadiazol-3-yl)butyl]quinoline-5-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-6-chloranyl-2-[4-(5-oxidanylidene-2H-1,2,4-oxadiazol-3-yl)butyl]quinoline-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-6-chloro-2-[4-(5-oxo-2H-1,2,4-oxadiazol-3-yl)butyl]quinoline-5-carboxamide CAS Name: N-(1-adamantylmethyl)-6-chloro-2-[4-(5-oxo-2H-1,2,4-oxadiazol-3-yl)butyl]-5-quinolinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-6-chloro-2-[4-(5-oxo-2H-1,2,4-oxadiazol-3-yl)butyl]quinoline-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-6-chloro-2-[4-(5-keto-2H-1,2,4-oxadiazol-3-yl)butyl]quinoline-5-carboxamide Formula: C27H31ClN4O3 MolecularWeight: 495.01304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC5=C4C=CC(=N5)CCCCC6=NC(=O)ON6)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC5=C4C=CC(=N5)CCCCC6=NC(=O)ON6)Cl

InChI

InChI=1S/C27H31ClN4O3/c28-21-7-8-22-20(6-5-19(30-22)3-1-2-4-23-31-26(34)35-32-23)24(21)25(33)29-15-27-12-16-9-17(13-27)11-18(10-16)14-27/h5-8,16-18H,1-4,9-15H2,(H,29,33)(H,31,32,34)