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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O3S2/c1-11(2)10-17-16(20)13(8-9-23-3)18-15-12-6-4-5-7-14(12)24(21,22)19-15/h4-7,11,13H,8-10H2,1-3H3,(H,17,20)(H,18,19)