4-(4-bromophenyl)-2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-bromophenyl)-2-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 4-(4-bromophenyl)-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]pyrimidine-5-carbonitrile CAS Name: 4-(4-bromophenyl)-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-bromophenyl)-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]pyrimidine-5-carbonitrile Traditional Name: 4-(4-bromophenyl)-2-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]pyrimidine-5-carbonitrile Formula: C19H13BrN6O2 MolecularWeight: 437.24952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(NC2=NC=C(C(=N2)C3=CC=C(C=C3)Br)C#N)N=O)NO

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/NC2=NC=C(C(=N2)C3=CC=C(C=C3)Br)C#N)\N=O)/NO

InChI

InChI=1S/C19H13BrN6O2/c20-15-8-6-13(7-9-15)16-14(10-21)11-22-19(23-16)24-18(26-28)17(25-27)12-4-2-1-3-5-12/h1-9,11,25,27H,(H,22,23,24)/b18-17+