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

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-butyl-4-methylsulfanyl-butanamide Openeye Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanyl-butanamide CAS Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)butanamide IUPAC Name: N-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-methylsulfanylbutanamide Traditional Name: N-butyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-(methylthio)butyramide Formula: C16H23N3O3S2 MolecularWeight: 369.50212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3S2/c1-3-4-10-17-16(20)13(9-11-23-2)18-15-12-7-5-6-8-14(12)24(21,22)19-15/h5-8,13H,3-4,9-11H2,1-2H3,(H,17,20)(H,18,19)