8-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline

Systemtic Name: 8-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Openeye Name: 8-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline CAS Name: 8-[[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]oxy]-2-methylquinoline IUPAC Name: 8-[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]oxy-2-methylquinoline Traditional Name: 8-[6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Formula: C20H13ClN4O3S MolecularWeight: 424.86022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13ClN4O3S/c1-12-5-6-13-3-2-4-16(17(13)24-12)28-19-18(25(26)27)20(23-11-22-19)29-15-9-7-14(21)8-10-15/h2-11H,1H3