N-(4-methoxy-2-nitro-phenyl)-6-methylsulfanyl-1,3-benzothiazol-2-amine

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-6-methylsulfanyl-1,3-benzothiazol-2-amine Openeye Name: N-(4-methoxy-2-nitro-phenyl)-6-methylsulfanyl-1,3-benzothiazol-2-amine CAS Name: N-(4-methoxy-2-nitrophenyl)-6-(methylthio)-1,3-benzothiazol-2-amine IUPAC Name: N-(4-methoxy-2-nitrophenyl)-6-methylsulfanyl-1,3-benzothiazol-2-amine Traditional Name: (4-methoxy-2-nitro-phenyl)-[6-(methylthio)-1,3-benzothiazol-2-yl]amine Formula: C15H13N3O3S2 MolecularWeight: 347.41202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC3=C(S2)C=C(C=C3)SC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC3=C(S2)C=C(C=C3)SC)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O3S2/c1-21-9-3-5-11(13(7-9)18(19)20)16-15-17-12-6-4-10(22-2)8-14(12)23-15/h3-8H,1-2H3,(H,16,17)