2-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethyl-ethanamide Openeye Name: 2-[3-(6-chloro-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxy-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethyl-acetamide CAS Name: 2-[3-[[6-chloro-2-(methylthio)-5-nitro-4-pyrimidinyl]oxy]-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethylacetamide IUPAC Name: 2-[3-(6-chloro-2-methylsulfanyl-5-nitropyrimidin-4-yl)oxy-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethylacetamide Traditional Name: 2-[3-[6-chloro-2-(methylthio)-5-nitro-pyrimidin-4-yl]oxy-5-(1H-imidazol-2-yl)phenyl]-N,N-dimethyl-acetamide Formula: C18H17ClN6O4S MolecularWeight: 448.88338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CC1=CC(=CC(=C1)C2=NC=CN2)OC3=C(C(=NC(=N3)SC)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CC1=CC(=CC(=C1)C2=NC=CN2)OC3=C(C(=NC(=N3)SC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN6O4S/c1-24(2)13(26)8-10-6-11(16-20-4-5-21-16)9-12(7-10)29-17-14(25(27)28)15(19)22-18(23-17)30-3/h4-7,9H,8H2,1-3H3,(H,20,21)