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

Systemtic Name: N-[6-(5-bromanylquinolin-8-yl)oxy-5-nitro-pyrimidin-4-yl]-4,5-dimethyl-1,3-thiazol-2-amine Openeye Name: N-[6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-4,5-dimethyl-thiazol-2-amine CAS Name: N-[6-[(5-bromo-8-quinolinyl)oxy]-5-nitro-4-pyrimidinyl]-4,5-dimethyl-2-thiazolamine IUPAC Name: N-[6-(5-bromoquinolin-8-yl)oxy-5-nitropyrimidin-4-yl]-4,5-dimethyl-1,3-thiazol-2-amine Traditional Name: [6-[(5-bromo-8-quinolyl)oxy]-5-nitro-pyrimidin-4-yl]-(4,5-dimethylthiazol-2-yl)amine Formula: C18H13BrN6O3S MolecularWeight: 473.30322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC2=C(C(=NC=N2)OC3=C4C(=C(C=C3)Br)C=CC=N4)[N+](=O)[O-])C

InChI

InChI=1S/C18H13BrN6O3S/c1-9-10(2)29-18(23-9)24-16-15(25(26)27)17(22-8-21-16)28-13-6-5-12(19)11-4-3-7-20-14(11)13/h3-8H,1-2H3,(H,21,22,23,24)