2-[4-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[4-(cyclopropylamino)-5-nitro-2-pyrimidinyl]-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-[4-(cyclopropylamino)-5-nitropyrimidin-2-yl]piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]piperazino]-N-propyl-acetamide Formula: C16H25N7O3 MolecularWeight: 363.4148

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1CCN(CC1)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CN1CCN(CC1)C2=NC=C(C(=N2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H25N7O3/c1-2-5-17-14(24)11-21-6-8-22(9-7-21)16-18-10-13(23(25)26)15(20-16)19-12-3-4-12/h10,12H,2-9,11H2,1H3,(H,17,24)(H,18,19,20)