5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-6-[2-(4-nitrophenyl)hydrazino]-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 5-nitro-6-[(4-nitrophenyl)hydrazo]-N-(phenylmethyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-6-[2-(4-nitrophenyl)hydrazinyl]-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: benzyl-[5-nitro-6-[N'-(4-nitrophenyl)hydrazino]pyrimidin-4-yl]-(2-pyridyl)amine Formula: C22H18N8O4 MolecularWeight: 458.42952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])NNC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=NC=NC(=C3[N+](=O)[O-])NNC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N8O4/c31-29(32)18-11-9-17(10-12-18)26-27-21-20(30(33)34)22(25-15-24-21)28(19-8-4-5-13-23-19)14-16-6-2-1-3-7-16/h1-13,15,26H,14H2,(H,24,25,27)