6-isothiocyanato-2,2-bis(oxidanylidene)-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one

Systemtic Name: 6-isothiocyanato-2,2-bis(oxidanylidene)-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one Openeye Name: 3-isopropyl-6-isothiocyanato-2,2-dioxo-1H-2$l^{6},1,3-benzothiadiazin-4-one CAS Name: 6-isothiocyanato-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one IUPAC Name: 6-isothiocyanato-2,2-dioxo-3-propan-2-yl-1H-2$l^{6},1,3-benzothiadiazin-4-one Traditional Name: 3-isopropyl-6-isothiocyanato-2,2-diketo-1H-2$l^{6},1,3-benzothiadiazin-4-one Formula: C11H11N3O3S2 MolecularWeight: 297.35334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=CC(=C2)N=C=S)NS1(=O)=O

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=CC(=C2)N=C=S)NS1(=O)=O

InChI

InChI=1S/C11H11N3O3S2/c1-7(2)14-11(15)9-5-8(12-6-18)3-4-10(9)13-19(14,16)17/h3-5,7,13H,1-2H3