5-nitro-N-(4-phenoxyphenyl)-6-pyrrolidin-1-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(4-phenoxyphenyl)-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: 5-nitro-N-(4-phenoxyphenyl)-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: 5-nitro-N-(4-phenoxyphenyl)-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: 5-nitro-N-(4-phenoxyphenyl)-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: (5-nitro-6-pyrrolidino-pyrimidin-4-yl)-(4-phenoxyphenyl)amine Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)NC3=CC=C(C=C3)OC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O3/c26-25(27)18-19(21-14-22-20(18)24-12-4-5-13-24)23-15-8-10-17(11-9-15)28-16-6-2-1-3-7-16/h1-3,6-11,14H,4-5,12-13H2,(H,21,22,23)