2-(dimethylamino)-N-[[4-(5-iodanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-4-nitro-benzamide

Systemtic Name: 2-(dimethylamino)-N-[[4-(5-iodanylpyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-4-nitro-benzamide Openeye Name: 2-(dimethylamino)-N-[[4-(5-iodopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-4-nitro-benzamide CAS Name: 2-(dimethylamino)-N-[[4-[(5-iodo-2-pyrimidinyl)oxy]-3-methylanilino]-oxomethyl]-4-nitrobenzamide IUPAC Name: 2-(dimethylamino)-N-[[4-(5-iodopyrimidin-2-yl)oxy-3-methylphenyl]carbamoyl]-4-nitrobenzamide Traditional Name: 2-(dimethylamino)-N-[[4-(5-iodopyrimidin-2-yl)oxy-3-methyl-phenyl]carbamoyl]-4-nitro-benzamide Formula: C21H19IN6O5 MolecularWeight: 562.31723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])N(C)C)OC3=NC=C(C=N3)I

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])N(C)C)OC3=NC=C(C=N3)I

InChI

InChI=1S/C21H19IN6O5/c1-12-8-14(4-7-18(12)33-21-23-10-13(22)11-24-21)25-20(30)26-19(29)16-6-5-15(28(31)32)9-17(16)27(2)3/h4-11H,1-3H3,(H2,25,26,29,30)