N-(3-fluoranyl-4-methyl-phenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxyacetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide Formula: C19H20FN5O5S MolecularWeight: 449.456003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N=N2)F

InChI

InChI=1S/C19H20FN5O5S/c1-13-2-3-14(10-16(13)20)21-19(26)12-30-25-18-11-15(4-5-17(18)22-23-25)31(27,28)24-6-8-29-9-7-24/h2-5,10-11H,6-9,12H2,1H3,(H,21,26)