N-butyl-6-(2,2-diphenylhydrazinyl)-N-methyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butyl-6-(2,2-diphenylhydrazinyl)-N-methyl-5-nitro-pyrimidin-4-amine Openeye Name: N-butyl-6-(2,2-diphenylhydrazino)-N-methyl-5-nitro-pyrimidin-4-amine CAS Name: N-butyl-6-(2,2-diphenylhydrazinyl)-N-methyl-5-nitro-4-pyrimidinamine IUPAC Name: N-butyl-6-(2,2-diphenylhydrazinyl)-N-methyl-5-nitropyrimidin-4-amine Traditional Name: butyl-[6-(N',N'-diphenylhydrazino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NN(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NN(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N6O2/c1-3-4-15-25(2)21-19(27(28)29)20(22-16-23-21)24-26(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16H,3-4,15H2,1-2H3,(H,22,23,24)