4-[3-(imidazol-1-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine

Systemtic Name: 4-[3-(imidazol-1-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine Openeye Name: 4-[3-(imidazol-1-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine CAS Name: 4-[3-(1-imidazolylmethyl)phenyl]-N-(3-nitrophenyl)-2-pyrimidinamine IUPAC Name: 4-[3-(imidazol-1-ylmethyl)phenyl]-N-(3-nitrophenyl)pyrimidin-2-amine Traditional Name: [4-[3-(imidazol-1-ylmethyl)phenyl]pyrimidin-2-yl]-(3-nitrophenyl)amine Formula: C20H16N6O2 MolecularWeight: 372.38004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C=CN=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CN2C=CN=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O2/c27-26(28)18-6-2-5-17(12-18)23-20-22-8-7-19(24-20)16-4-1-3-15(11-16)13-25-10-9-21-14-25/h1-12,14H,13H2,(H,22,23,24)