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

Systemtic Name: 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N-[(E)-[2-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylideneamino]-5-(dimethylaminomethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[2-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]methyleneamino]-5-(dimethylaminomethyl)triazole-4-carboxamide CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylideneamino]-5-(dimethylaminomethyl)-4-triazolecarboxamide IUPAC Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylideneamino]-5-(dimethylaminomethyl)triazole-4-carboxamide Traditional Name: 1-(4-aminofurazan-3-yl)-N-[(E)-[2-(2-chloro-6-fluoro-benzyl)oxybenzylidene]amino]-5-(dimethylaminomethyl)triazole-4-carboxamide Formula: C22H21ClFN9O3 MolecularWeight: 513.912043

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC=CC=C3OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

CN(C)CC1=C(N=NN1C2=NON=C2N)C(=O)N/N=C/C3=CC=CC=C3OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H21ClFN9O3/c1-32(2)11-17-19(27-31-33(17)21-20(25)29-36-30-21)22(34)28-26-10-13-6-3-4-9-18(13)35-12-14-15(23)7-5-8-16(14)24/h3-10H,11-12H2,1-2H3,(H2,25,29)(H,28,34)/b26-10+