4,5-dimethyl-N-(5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)-1,3-thiazol-2-amine

Systemtic Name: 4,5-dimethyl-N-(5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-yl)-1,3-thiazol-2-amine Openeye Name: 4,5-dimethyl-N-[5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-yl]thiazol-2-amine CAS Name: 4,5-dimethyl-N-[5-nitro-6-(8-quinolinylthio)-4-pyrimidinyl]-2-thiazolamine IUPAC Name: 4,5-dimethyl-N-(5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-yl)-1,3-thiazol-2-amine Traditional Name: (4,5-dimethylthiazol-2-yl)-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]amine Formula: C18H14N6O2S2 MolecularWeight: 410.47276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C18H14N6O2S2/c1-10-11(2)27-18(22-10)23-16-15(24(25)26)17(21-9-20-16)28-13-7-3-5-12-6-4-8-19-14(12)13/h3-9H,1-2H3,(H,20,21,22,23)