4-methyl-5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-2-amine

Systemtic Name: 4-methyl-5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-2-amine Openeye Name: 4-methyl-5-nitro-N-phenethyl-6-pyrrolidin-1-yl-pyrimidin-2-amine CAS Name: 4-methyl-5-nitro-N-phenethyl-6-(1-pyrrolidinyl)-2-pyrimidinamine IUPAC Name: 4-methyl-5-nitro-N-phenethyl-6-pyrrolidin-1-ylpyrimidin-2-amine Traditional Name: (4-methyl-5-nitro-6-pyrrolidino-pyrimidin-2-yl)-phenethyl-amine Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)NCCC2=CC=CC=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)NCCC2=CC=CC=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O2/c1-13-15(22(23)24)16(21-11-5-6-12-21)20-17(19-13)18-10-9-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-12H2,1H3,(H,18,19,20)