N-(3-methylpyridin-2-yl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(3-methylpyridin-2-yl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-(3-methyl-2-pyridyl)-5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: N-(3-methyl-2-pyridinyl)-5-nitro-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: N-(3-methylpyridin-2-yl)-5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: (3-methyl-2-pyridyl)-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]amine Formula: C19H14N6O2S MolecularWeight: 390.41846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N6O2S/c1-12-5-3-10-21-17(12)24-18-16(25(26)27)19(23-11-22-18)28-14-8-2-6-13-7-4-9-20-15(13)14/h2-11H,1H3,(H,21,22,23,24)