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

Systemtic Name: 3-[bis(azanyl)methylideneamino]oxy-2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]butanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-guanidinooxy-2-[6-methyl-3-(m-tolylsulfonylamino)-2-oxo-1-pyridyl]butanamide; 2,2,2-trifluoroacetic acid CAS Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]butanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxopyridin-1-yl]butanamide; 2,2,2-trifluoroacetic acid Traditional Name: 3-guanidinooxy-2-[2-keto-6-methyl-3-(m-tolylsulfonylamino)-1-pyridyl]butyramide; 2,2,2-trifluoroacetic acid Formula: C20H25F3N6O7S MolecularWeight: 550.50871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(N(C2=O)C(C(C)ON=C(N)N)C(=O)N)C.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC=C(N(C2=O)C(C(C)ON=C(N)N)C(=O)N)C.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H24N6O5S.C2HF3O2/c1-10-5-4-6-13(9-10)30(27,28)23-14-8-7-11(2)24(17(14)26)15(16(19)25)12(3)29-22-18(20)21;3-2(4,5)1(6)7/h4-9,12,15,23H,1-3H3,(H2,19,25)(H4,20,21,22);(H,6,7)