2-methyl-8-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)oxy-quinoline

Systemtic Name: 2-methyl-8-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)oxy-quinoline Openeye Name: 2-methyl-8-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)oxy-quinoline CAS Name: 2-methyl-8-[[5-nitro-6-(phenylthio)-4-pyrimidinyl]oxy]quinoline IUPAC Name: 2-methyl-8-(5-nitro-6-phenylsulfanylpyrimidin-4-yl)oxyquinoline Traditional Name: 2-methyl-8-[5-nitro-6-(phenylthio)pyrimidin-4-yl]oxy-quinoline Formula: C20H14N4O3S MolecularWeight: 390.41516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-])C=C1

InChI

InChI=1S/C20H14N4O3S/c1-13-10-11-14-6-5-9-16(17(14)23-13)27-19-18(24(25)26)20(22-12-21-19)28-15-7-3-2-4-8-15/h2-12H,1H3