3-[bis(azanyl)methylideneamino]oxy-2-[6-methyl-2-oxidanylidene-3-(quinolin-8-ylsulfonylamino)pyridin-1-yl]butanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-[bis(azanyl)methylideneamino]oxy-2-[6-methyl-2-oxidanylidene-3-(quinolin-8-ylsulfonylamino)pyridin-1-yl]butanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-guanidinooxy-2-[6-methyl-2-oxo-3-(8-quinolylsulfonylamino)-1-pyridyl]butanamide; 2,2,2-trifluoroacetic acid CAS Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-2-oxo-3-(8-quinolinylsulfonylamino)-1-pyridinyl]butanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-2-oxo-3-(quinolin-8-ylsulfonylamino)pyridin-1-yl]butanamide; 2,2,2-trifluoroacetic acid Traditional Name: 3-guanidinooxy-2-[2-keto-6-methyl-3-(8-quinolylsulfonylamino)-1-pyridyl]butyramide; 2,2,2-trifluoroacetic acid Formula: C22H24F3N7O7S MolecularWeight: 587.52887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1C(C(C)ON=C(N)N)C(=O)N)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C(=O)N1C(C(C)ON=C(N)N)C(=O)N)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H23N7O5S.C2HF3O2/c1-11-8-9-14(19(29)27(11)17(18(21)28)12(2)32-25-20(22)23)26-33(30,31)15-7-3-5-13-6-4-10-24-16(13)15;3-2(4,5)1(6)7/h3-10,12,17,26H,1-2H3,(H2,21,28)(H4,22,23,25);(H,6,7)