4-chloranyl-2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[2-(methylthio)-1,3-benzothiazol-6-yl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[[2-(methylthio)-1,3-benzothiazol-6-yl]iminomethyl]-6-nitro-phenolate Formula: C15H9ClN3O3S2- MolecularWeight: 378.83326

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10ClN3O3S2/c1-23-15-18-11-3-2-10(6-13(11)24-15)17-7-8-4-9(16)5-12(14(8)20)19(21)22/h2-7,20H,1H3/p-1