(2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methyl-pentanamide

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-methyl-pentanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methyl-pentanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylpentanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylpentanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-methyl-valeramide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)NC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C13H17N3O3S/c1-8(2)7-10(12(14)17)15-13-9-5-3-4-6-11(9)20(18,19)16-13/h3-6,8,10H,7H2,1-2H3,(H2,14,17)(H,15,16)/t10-/m0/s1