(2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-ethyl-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-ethyl-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethyl-4-methylsulfanyl-butanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethyl-4-(methylthio)butanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-ethyl-4-methylsulfanylbutanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-ethyl-4-(methylthio)butyramide Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(CCSC)NC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3S2/c1-3-15-14(18)11(8-9-21-2)16-13-10-6-4-5-7-12(10)22(19,20)17-13/h4-7,11H,3,8-9H2,1-2H3,(H,15,18)(H,16,17)/t11-/m0/s1