3-[bis(azanyl)methylideneamino]oxy-N-methyl-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-N-methyl-2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]butanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-guanidinooxy-N-methyl-2-[6-methyl-3-(m-tolylsulfonylamino)-2-oxo-1-pyridyl]butanamide; 2,2,2-trifluoroacetic acid CAS Name: 3-(diaminomethylideneamino)oxy-N-methyl-2-[6-methyl-3-[(3-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]butanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 3-(diaminomethylideneamino)oxy-N-methyl-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]-N-methyl-butyramide; 2,2,2-trifluoroacetic acid Formula: C21H27F3N6O7S MolecularWeight: 564.53529

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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)NC)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)NC)C.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H26N6O5S.C2HF3O2/c1-11-6-5-7-14(10-11)31(28,29)24-15-9-8-12(2)25(18(15)27)16(17(26)22-4)13(3)30-23-19(20)21;3-2(4,5)1(6)7/h5-10,13,16,24H,1-4H3,(H,22,26)(H4,20,21,23);(H,6,7)