N-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine Openeye Name: N-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-1,3-benzothiazol-2-amine CAS Name: N-[6-[(5-bromo-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[6-(5-bromoquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]amine Formula: C20H11BrN6O3S MolecularWeight: 495.30874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C20H11BrN6O3S/c21-12-7-8-14(16-11(12)4-3-9-22-16)30-19-17(27(28)29)18(23-10-24-19)26-20-25-13-5-1-2-6-15(13)31-20/h1-10H,(H,23,24,25,26)