1,1-bis(oxidanylidene)-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile

Systemtic Name: 1,1-bis(oxidanylidene)-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile Openeye Name: 1,1-dioxo-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile CAS Name: 1,1-dioxo-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile IUPAC Name: 1,1-dioxo-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile Traditional Name: 1,1-diketo-3-propyl-6-(trifluoromethyl)-4H-1$l^{6},4-benzothiazine-2-carbonitrile Formula: C13H11F3N2O2S MolecularWeight: 316.29885

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(S(=O)(=O)C2=C(N1)C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CCCC1=C(S(=O)(=O)C2=C(N1)C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C13H11F3N2O2S/c1-2-3-9-12(7-17)21(19,20)11-5-4-8(13(14,15)16)6-10(11)18-9/h4-6,18H,2-3H2,1H3