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

Systemtic Name: 2-methyl-N-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)quinolin-8-amine Openeye Name: 2-methyl-N-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]quinolin-8-amine CAS Name: 2-methyl-N-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]-8-quinolinamine IUPAC Name: 2-methyl-N-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)quinolin-8-amine Traditional Name: (2-methyl-8-quinolyl)-(5-nitro-6-piperidino-pyrimidin-4-yl)amine Formula: C19H20N6O2 MolecularWeight: 364.4011

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4CCCCC4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])N4CCCCC4)C=C1

InChI

InChI=1S/C19H20N6O2/c1-13-8-9-14-6-5-7-15(16(14)22-13)23-18-17(25(26)27)19(21-12-20-18)24-10-3-2-4-11-24/h5-9,12H,2-4,10-11H2,1H3,(H,20,21,23)