(3Z)-7-bromanyl-1,1-bis(oxidanylidene)-3-[oxidanyl-[(4-oxidanylidene-3-phenyl-2-sulfanylidene-imidazolidin-1-yl)amino]methylidene]-2-prop-2-enyl-1$l^{6},2-benzothiazin-4-one

Systemtic Name: (3Z)-7-bromanyl-1,1-bis(oxidanylidene)-3-[oxidanyl-[(4-oxidanylidene-3-phenyl-2-sulfanylidene-imidazolidin-1-yl)amino]methylidene]-2-prop-2-enyl-1$l^{6},2-benzothiazin-4-one Openeye Name: (3Z)-2-allyl-7-bromo-3-[hydroxy-[(4-oxo-3-phenyl-2-thioxo-imidazolidin-1-yl)amino]methylene]-1,1-dioxo-1$l^{6},2-benzothiazin-4-one CAS Name: (3Z)-7-bromo-3-[hydroxy-[(4-oxo-3-phenyl-2-sulfanylidene-1-imidazolidinyl)amino]methylidene]-1,1-dioxo-2-prop-2-enyl-1$l^{6},2-benzothiazin-4-one IUPAC Name: (3Z)-7-bromo-3-[hydroxy-[(4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl)amino]methylidene]-1,1-dioxo-2-prop-2-enyl-1$l^{6},2-benzothiazin-4-one Traditional Name: (3Z)-2-allyl-7-bromo-3-[hydroxy-[(4-keto-3-phenyl-2-thioxo-imidazolidin-1-yl)amino]methylene]-1,1-diketo-1$l^{6},2-benzothiazin-4-one Formula: C21H17BrN4O5S2 MolecularWeight: 549.41748

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(NN2CC(=O)N(C2=S)C3=CC=CC=C3)O)C(=O)C4=C(S1(=O)=O)C=C(C=C4)Br

Isomeric SMILES

C=CCN1/C(=C(/NN2CC(=O)N(C2=S)C3=CC=CC=C3)\O)/C(=O)C4=C(S1(=O)=O)C=C(C=C4)Br

InChI

InChI=1S/C21H17BrN4O5S2/c1-2-10-25-18(19(28)15-9-8-13(22)11-16(15)33(25,30)31)20(29)23-24-12-17(27)26(21(24)32)14-6-4-3-5-7-14/h2-9,11,23,29H,1,10,12H2/b20-18-