N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-pyrimidin-4-amine Openeye Name: N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-pyrimidin-4-amine CAS Name: N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-4-pyrimidinamine IUPAC Name: N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitropyrimidin-4-amine Traditional Name: butyl-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H23N5O2/c1-3-4-10-21(2)17-16(23(24)25)18(20-13-19-17)22-11-9-14-7-5-6-8-15(14)12-22/h5-8,13H,3-4,9-12H2,1-2H3