5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: 5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: 5-nitro-N-phenethyl-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: 5-nitro-N-phenethyl-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: (5-nitro-6-pyrrolidino-pyrimidin-4-yl)-phenethyl-amine Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O2/c22-21(23)14-15(17-9-8-13-6-2-1-3-7-13)18-12-19-16(14)20-10-4-5-11-20/h1-3,6-7,12H,4-5,8-11H2,(H,17,18,19)