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

Systemtic Name: 3-[bis(azanyl)methylideneamino]oxy-2-[6-methyl-3-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-pyridin-1-yl]butanamide Openeye Name: 3-guanidinooxy-2-[6-methyl-3-(1-naphthylsulfonylamino)-2-oxo-1-pyridyl]butanamide CAS Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-3-(1-naphthalenylsulfonylamino)-2-oxo-1-pyridinyl]butanamide IUPAC Name: 3-(diaminomethylideneamino)oxy-2-[6-methyl-3-(naphthalen-1-ylsulfonylamino)-2-oxopyridin-1-yl]butanamide Traditional Name: 3-guanidinooxy-2-[2-keto-6-methyl-3-(1-naphthylsulfonylamino)-1-pyridyl]butyramide Formula: C21H24N6O5S MolecularWeight: 472.51746

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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=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C(=O)N1C(C(C)ON=C(N)N)C(=O)N)NS(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N6O5S/c1-12-10-11-16(20(29)27(12)18(19(22)28)13(2)32-25-21(23)24)26-33(30,31)17-9-5-7-14-6-3-4-8-15(14)17/h3-11,13,18,26H,1-2H3,(H2,22,28)(H4,23,24,25)