N-aminocarbonyl-3-methyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-butanamide

Systemtic Name: N-aminocarbonyl-3-methyl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-butanamide Openeye Name: N-carbamoyl-3-methyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-butanamide CAS Name: N-carbamoyl-3-methyl-2-[(1-oxido-2-pyridin-1-iumyl)thio]butanamide IUPAC Name: N-carbamoyl-3-methyl-2-(1-oxidopyridin-1-ium-2-yl)sulfanylbutanamide Traditional Name: N-carbamoyl-3-methyl-2-[(1-oxidopyridin-1-ium-2-yl)thio]butyramide Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=CC=CC=[N+]1[O-]

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=CC=CC=[N+]1[O-]

InChI

InChI=1S/C11H15N3O3S/c1-7(2)9(10(15)13-11(12)16)18-8-5-3-4-6-14(8)17/h3-7,9H,1-2H3,(H3,12,13,15,16)