3-[bis(azanyl)methylideneamino]oxy-2-[3-[(2-iodanylphenyl)methylsulfonylamino]-6-methyl-2-oxidanylidene-pyridin-1-yl]butanamide

Systemtic Name: 3-[bis(azanyl)methylideneamino]oxy-2-[3-[(2-iodanylphenyl)methylsulfonylamino]-6-methyl-2-oxidanylidene-pyridin-1-yl]butanamide Openeye Name: 3-guanidinooxy-2-[3-[(2-iodophenyl)methylsulfonylamino]-6-methyl-2-oxo-1-pyridyl]butanamide CAS Name: 3-(diaminomethylideneamino)oxy-2-[3-[(2-iodophenyl)methylsulfonylamino]-6-methyl-2-oxo-1-pyridinyl]butanamide IUPAC Name: 3-(diaminomethylideneamino)oxy-2-[3-[(2-iodophenyl)methylsulfonylamino]-6-methyl-2-oxopyridin-1-yl]butanamide Traditional Name: 3-guanidinooxy-2-[3-[(2-iodobenzyl)sulfonylamino]-2-keto-6-methyl-1-pyridyl]butyramide Formula: C18H23IN6O5S MolecularWeight: 562.38189

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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)CC2=CC=CC=C2I

Isomeric SMILES

CC1=CC=C(C(=O)N1C(C(C)ON=C(N)N)C(=O)N)NS(=O)(=O)CC2=CC=CC=C2I

InChI

InChI=1S/C18H23IN6O5S/c1-10-7-8-14(24-31(28,29)9-12-5-3-4-6-13(12)19)17(27)25(10)15(16(20)26)11(2)30-23-18(21)22/h3-8,11,15,24H,9H2,1-2H3,(H2,20,26)(H4,21,22,23)