N-methyl-5-nitro-N-phenyl-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-methyl-5-nitro-N-phenyl-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-methyl-5-nitro-N-phenyl-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: N-methyl-5-nitro-N-phenyl-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: N-methyl-5-nitro-N-phenyl-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: methyl-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]-phenyl-amine Formula: C20H15N5O2S MolecularWeight: 389.4304

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O2S/c1-24(15-9-3-2-4-10-15)19-18(25(26)27)20(23-13-22-19)28-16-11-5-7-14-8-6-12-21-17(14)16/h2-13H,1H3