5-[(3S)-3-azanylpyrrolidin-1-yl]-6-bromanyl-3-nitro-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-[(3S)-3-azanylpyrrolidin-1-yl]-6-bromanyl-3-nitro-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-[(3S)-3-aminopyrrolidin-1-yl]-6-bromo-3-nitro-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-[(3S)-3-amino-1-pyrrolidinyl]-6-bromo-3-nitro-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-[(3S)-3-aminopyrrolidin-1-yl]-6-bromo-3-nitropyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [(3S)-1-(7-amino-6-bromo-3-nitro-pyrazolo[1,5-a]pyrimidin-5-yl)pyrrolidin-3-yl]amine Formula: C10H12BrN7O2 MolecularWeight: 342.15198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=NC3=C(C=NN3C(=C2Br)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(C[C@H]1N)C2=NC3=C(C=NN3C(=C2Br)N)[N+](=O)[O-]

InChI

InChI=1S/C10H12BrN7O2/c11-7-8(13)17-9(6(3-14-17)18(19)20)15-10(7)16-2-1-5(12)4-16/h3,5H,1-2,4,12-13H2/t5-/m0/s1