N-[4-[[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide

Systemtic Name: N-[4-[[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]ethanamide Openeye Name: N-[4-[[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide CAS Name: N-[4-[[6-(3-methoxypropylamino)-5-nitro-4-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[6-(3-methoxypropylamino)-5-nitropyrimidin-4-yl]amino]phenyl]acetamide Traditional Name: N-[4-[[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amino]phenyl]acetamide Formula: C16H20N6O4 MolecularWeight: 360.3678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCCOC)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O4/c1-11(23)20-12-4-6-13(7-5-12)21-16-14(22(24)25)15(18-10-19-16)17-8-3-9-26-2/h4-7,10H,3,8-9H2,1-2H3,(H,20,23)(H2,17,18,19,21)