N-(furan-2-ylmethyl)-6-nitro-1,3-benzothiazol-2-amine

Systemtic Name: N-(furan-2-ylmethyl)-6-nitro-1,3-benzothiazol-2-amine Openeye Name: N-(2-furylmethyl)-6-nitro-1,3-benzothiazol-2-amine CAS Name: N-(2-furanylmethyl)-6-nitro-1,3-benzothiazol-2-amine IUPAC Name: N-(furan-2-ylmethyl)-6-nitro-1,3-benzothiazol-2-amine Traditional Name: 2-furfuryl-(6-nitro-1,3-benzothiazol-2-yl)amine Formula: C12H9N3O3S MolecularWeight: 275.28316

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O3S/c16-15(17)8-3-4-10-11(6-8)19-12(14-10)13-7-9-2-1-5-18-9/h1-6H,7H2,(H,13,14)