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

Systemtic Name: 3-[bis(azanyl)methylideneamino]oxy-2-[3-[(3-bromophenyl)sulfonylamino]-6-methyl-2-oxidanylidene-pyridin-1-yl]butanamide Openeye Name: 2-[3-[(3-bromophenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridyl]-3-guanidinooxy-butanamide CAS Name: 2-[3-[(3-bromophenyl)sulfonylamino]-6-methyl-2-oxo-1-pyridinyl]-3-(diaminomethylideneamino)oxybutanamide IUPAC Name: 2-[3-[(3-bromophenyl)sulfonylamino]-6-methyl-2-oxopyridin-1-yl]-3-(diaminomethylideneamino)oxybutanamide Traditional Name: 2-[3-[(3-bromophenyl)sulfonylamino]-2-keto-6-methyl-1-pyridyl]-3-guanidinooxy-butyramide Formula: C17H21BrN6O5S MolecularWeight: 501.35484

Click to see the large picture

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(=CC=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H21BrN6O5S/c1-9-6-7-13(23-30(27,28)12-5-3-4-11(18)8-12)16(26)24(9)14(15(19)25)10(2)29-22-17(20)21/h3-8,10,14,23H,1-2H3,(H2,19,25)(H4,20,21,22)