N-butan-2-yl-7-fluoranyl-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-amine hydrate

Systemtic Name: N-butan-2-yl-7-fluoranyl-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-amine hydrate Openeye Name: 7-fluoro-1,1-dioxo-N-sec-butyl-4H-1$l^{6},2,4-benzothiadiazin-3-amine hydrate CAS Name: N-butan-2-yl-7-fluoro-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-amine hydrate IUPAC Name: N-butan-2-yl-7-fluoro-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-amine hydrate Traditional Name: (7-fluoro-1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-sec-butyl-amine hydrate Formula: C11H16FN3O3S MolecularWeight: 289.326443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)F.O

Isomeric SMILES

CCC(C)NC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)F.O

InChI

InChI=1S/C11H14FN3O2S.H2O/c1-3-7(2)13-11-14-9-5-4-8(12)6-10(9)18(16,17)15-11;/h4-7H,3H2,1-2H3,(H2,13,14,15);1H2