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

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-3-methyl-butanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methyl-butanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylbutanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-3-methylbutanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-3-methyl-butyramide Formula: C12H15N3O3S MolecularWeight: 281.3308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O3S/c1-7(2)10(11(13)16)14-12-8-5-3-4-6-9(8)19(17,18)15-12/h3-7,10H,1-2H3,(H2,13,16)(H,14,15)/t10-/m0/s1