1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[(Z)-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylideneamino]-5-[(2-methylpiperidin-1-yl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[(Z)-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylideneamino]-5-[(2-methylpiperidin-1-yl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(Z)-[4-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]methyleneamino]-5-[(2-methyl-1-piperidyl)methyl]triazole-4-carboxamide CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(Z)-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylideneamino]-5-[(2-methyl-1-piperidinyl)methyl]-4-triazolecarboxamide IUPAC Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(Z)-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylideneamino]-5-[(2-methylpiperidin-1-yl)methyl]triazole-4-carboxamide Traditional Name: 1-(4-aminofurazan-3-yl)-N-[(Z)-[4-(2-chloro-6-fluoro-benzyl)oxybenzylidene]amino]-5-[(2-methylpiperidino)methyl]triazole-4-carboxamide Formula: C26H27ClFN9O3 MolecularWeight: 568.002483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)OCC5=C(C=CC=C5Cl)F

Isomeric SMILES

CC1CCCCN1CC2=C(N=NN2C3=NON=C3N)C(=O)N/N=C\C4=CC=C(C=C4)OCC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C26H27ClFN9O3/c1-16-5-2-3-12-36(16)14-22-23(31-35-37(22)25-24(29)33-40-34-25)26(38)32-30-13-17-8-10-18(11-9-17)39-15-19-20(27)6-4-7-21(19)28/h4,6-11,13,16H,2-3,5,12,14-15H2,1H3,(H2,29,33)(H,32,38)/b30-13-