N4,N6-bis(5-iodanyl-2-methyl-phenyl)-2-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N6-bis(5-iodanyl-2-methyl-phenyl)-2-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N6-bis(5-iodo-2-methyl-phenyl)-2-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N6-bis(5-iodo-2-methylphenyl)-2-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-bis(5-iodo-2-methylphenyl)-2-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(5-iodo-2-methyl-anilino)-2-methyl-5-nitro-pyrimidin-4-yl]-(5-iodo-2-methyl-phenyl)amine Formula: C19H17I2N5O2 MolecularWeight: 601.17952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)I)NC2=C(C(=NC(=N2)C)NC3=C(C=CC(=C3)I)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)I)NC2=C(C(=NC(=N2)C)NC3=C(C=CC(=C3)I)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17I2N5O2/c1-10-4-6-13(20)8-15(10)24-18-17(26(27)28)19(23-12(3)22-18)25-16-9-14(21)7-5-11(16)2/h4-9H,1-3H3,(H2,22,23,24,25)