2-methyl-N-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)quinolin-8-amine

Systemtic Name: 2-methyl-N-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)quinolin-8-amine Openeye Name: 2-methyl-N-(5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-yl)quinolin-8-amine CAS Name: 2-methyl-N-[5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinyl]-8-quinolinamine IUPAC Name: 2-methyl-N-(5-nitro-6-pyrrolidin-1-ylpyrimidin-4-yl)quinolin-8-amine Traditional Name: (2-methyl-8-quinolyl)-(5-nitro-6-pyrrolidino-pyrimidin-4-yl)amine Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4CCCC4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4CCCC4)C=C1

InChI

InChI=1S/C18H18N6O2/c1-12-7-8-13-5-4-6-14(15(13)21-12)22-17-16(24(25)26)18(20-11-19-17)23-9-2-3-10-23/h4-8,11H,2-3,9-10H2,1H3,(H,19,20,22)