N-[6-(4,6-dimethylpyrimidin-2-yl)sulfanylhexyl]aniline

Systemtic Name: N-[6-(4,6-dimethylpyrimidin-2-yl)sulfanylhexyl]aniline Openeye Name: N-[6-(4,6-dimethylpyrimidin-2-yl)sulfanylhexyl]aniline CAS Name: N-[6-[(4,6-dimethyl-2-pyrimidinyl)thio]hexyl]aniline IUPAC Name: N-[6-(4,6-dimethylpyrimidin-2-yl)sulfanylhexyl]aniline Traditional Name: 6-[(4,6-dimethylpyrimidin-2-yl)thio]hexyl-phenyl-amine Formula: C18H25N3S MolecularWeight: 315.4762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCCCCCNC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCCCCCNC2=CC=CC=C2)C

InChI

InChI=1S/C18H25N3S/c1-15-14-16(2)21-18(20-15)22-13-9-4-3-8-12-19-17-10-6-5-7-11-17/h5-7,10-11,14,19H,3-4,8-9,12-13H2,1-2H3