N-(3-imidazol-1-ylpropyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: 3-imidazol-1-ylpropyl-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]amine Formula: C20H24N8O2 MolecularWeight: 408.45696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NCCCN4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NCCCN4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N8O2/c29-28(30)18-19(22-7-4-9-25-10-8-21-16-25)23-15-24-20(18)27-13-11-26(12-14-27)17-5-2-1-3-6-17/h1-3,5-6,8,10,15-16H,4,7,9,11-14H2,(H,22,23,24)