1-ethyl-N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]benzotriazole-5-carboxamide Formula: C19H16FN5O2S MolecularWeight: 397.426043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)F)N=N1

InChI

InChI=1S/C19H16FN5O2S/c1-3-25-16-6-4-12(9-14(16)23-24-25)18(26)22-19-21-15(10-28-19)11-5-7-17(27-2)13(20)8-11/h4-10H,3H2,1-2H3,(H,21,22,26)